SCHEMBL13222013

SCHEMBL13222013

CC(C)(C)c1c2ccccc2nc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.55
▸ KDM4E B2RXH2 6/20 0.50
▸ ALDH1A1 P00352 5/20 0.50
▸ HPGD P15428 4/20 0.50
▸ GLA P06280 3/20 0.50
▸ POLB P06746 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ MAOA P21397 2/20 0.50
▸ CASP1 P29466 2/20 0.50
▸ CASP7 P55210 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ CHRM2 P08172 1/20 0.50
▸ ADRA2A P08913 1/20 0.50
▸ ADORA3 P0DMS8 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ NQO2 P16083 1/20 0.50
▸ DRD1 P21728 1/20 0.50
▸ ACHE P22303 1/20 0.50
▸ SLC6A2 P23975 1/20 0.50
▸ ADRA1A P35348 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28920770 0.83 ATM (0.44) ATMKDM4EALDH1A1HPGDGLA
SCHEMBL14506374 0.81 ATM (0.43) ATMKDM4EALDH1A1HPGDGLA
SCHEMBL21791642 0.81 TYMS (0.44) ATMKDM4EALDH1A1HPGDGLA
SCHEMBL24604916 0.81 DHODH (0.41) ATMKDM4EALDH1A1POLBELANE
SCHEMBL16801733 0.81 MAOA (0.50) ATMALDH1A1POLBHSD17B10MAOA
SCHEMBL30849704 0.79 CYP1A2 (0.40) ATMKDM4EALDH1A1HPGDHSD17B10
SCHEMBL16132394 0.78 GPR3 (0.50) ATMKDM4EALDH1A1HPGDPOLB
SCHEMBL5720497 0.78 KDM4E (0.52) ATMKDM4EALDH1A1HPGDGLA
SCHEMBL5720410 0.76 MAOA (0.56) ATMKDM4EALDH1A1HPGDGLA
SCHEMBL16132377 0.76 GPR3 (0.47) ATMKDM4EALDH1A1HPGDPOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230372309-A1 ALPHA-2 ADRENERGIC RECEPTOR ANTAGONIST KYOTO UNIVERSITY (JP) 2023-11-23 — — US disclosed
US-20230372309-A1 ALPHA-2 ADRENERGIC RECEPTOR ANTAGONIST KYOTO UNIVERSITY (JP) 2023-11-23 — — US disclosed
US-11690850-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-07-04 — — US disclosed
US-11690850-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-07-04 — — US disclosed
US-20230038201-A1 TRANSFER FILM, PHOTOSENSITIVE MATERIAL, PATTERN FORMING METHOD, MANUFACTURING METHOD OF CIRCUIT BOARD, AND MANUFACTURING METHOD OF TOUCH PANEL FUJIFILM CORPORATION (JP) 2023-02-09 — — US disclosed
US-20220216426-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-07 — — US disclosed
US-20210154204-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2021-05-27 — — US disclosed
US-20200251662-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY PANEL Wuhan China Star Optoelectronics Semicondutor Display Technology Co., Ltd. (CN) 2020-08-06 — — US disclosed
US-20200071276-A1 Acridine Compound for Use in an Electronic Device and Display Device NOVALED GMBH (DE) 2020-03-05 — — US disclosed
US-10035765-B2 Nitrogen-containing polycyclic compound and organic light emitting device using same LG CHEM, LTD. (KR) 2018-07-31 — — US disclosed
US-20170283379-A1 NITROGEN-CONTAINING POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME (AS AMENDED) LG CHEM, LTD. (KR) 2017-10-05 — — US disclosed
US-20170283379-A1 NITROGEN-CONTAINING POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME (AS AMENDED) LG CHEM, LTD. (KR) 2017-10-05 — — US disclosed
US-20170152260-A1 STAT3 INHIBITOR BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-06-01 — — US disclosed
US-20170152260-A1 STAT3 INHIBITOR BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-06-01 — — US disclosed
US-9562002-B2 STAT3 inhibitor BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-02-07 — — US disclosed
US-9562002-B2 STAT3 inhibitor BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-02-07 — — US disclosed
US-20150361031-A1 STAT3 INHIBITOR BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-12-17 — — US disclosed
US-9133115-B2 4-amino-4-oxobutanoyl peptides as inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2015-09-15 — — US disclosed
US-20140113890-A1 NEW 4-AMINO-4-OXOBUTANOYL PEPTIDES AS INHIBITORS OF VIRAL REPLICATION ACHILLION PHARMACEUTICALS, INC. (US) 2014-04-24 — — US disclosed
US-20100216725-A1 4-AMINO-4-OXOBUTANOYL PEPTIDES AS INHIBITORS OF VIRAL REPLICATION ACHILLION PHARMACEUTICALS, INC. (US) 2010-08-26 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11690850-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease RIPK1, RIPK2, RIPK4 ATM 869/4885KDM4E 3689/4885ALDH1A1 4554/4885
US-20230372309-A1 ALPHA-2 ADRENERGIC RECEPTOR ANTAGONIST ADRA2A, ADRB2, ADRA2B ATM 4176/4885KDM4E 4114/4885ALDH1A1 407/4885
US-20170283379-A1 NITROGEN-CONTAINING POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME (AS AMENDED) PER2, CRY1, CRY2 ATM 1605/4885KDM4E 1594/4885ALDH1A1 1815/4885
US-20200251662-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY PANEL TEAD2, TEAD1, TEAD3 ATM 1079/4885KDM4E 3584/4885ALDH1A1 115/4885
US-20210154204-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE RIPK1, RIPK2, RIPK4 ATM 869/4885KDM4E 3689/4885ALDH1A1 4554/4885
US-20140113890-A1 NEW 4-AMINO-4-OXOBUTANOYL PEPTIDES AS INHIBITORS OF VIRAL REPLICATION ZC3HAV1, VIP, ZC3HAV1L ATM 4864/4885KDM4E 556/4885ALDH1A1 4204/4885
US-20170152260-A1 STAT3 INHIBITOR STAT3, STAT1, STAT4 ATM 377/4885KDM4E 3388/4885ALDH1A1 2922/4885
US-20100216725-A1 4-AMINO-4-OXOBUTANOYL PEPTIDES AS INHIBITORS OF VIRAL REPLICATION ZC3HAV1, VIP, O60361 ATM 4855/4885KDM4E 493/4885ALDH1A1 4184/4885
US-20200071276-A1 Acridine Compound for Use in an Electronic Device and Display Device ACR, ALDH1A1, TRPA1 ATM 1394/4885KDM4E 3497/4885ALDH1A1 2/4885
US-20220216426-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS NCL, DNMT3A, NUDT1 ATM 666/4885KDM4E 3514/4885ALDH1A1 1167/4885
US-20150361031-A1 STAT3 INHIBITOR STAT3, STAT1, STAT4 ATM 377/4885KDM4E 3388/4885ALDH1A1 2922/4885
US-10035765-B2 Nitrogen-containing polycyclic compound and organic light emitting device using same NPM1, PER2, CRY1 ATM 2242/4885KDM4E 1641/4885ALDH1A1 2342/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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