SCHEMBL9458294

SCHEMBL9458294

O=C1OC(=O)C2C3C=CC(C4C=CC43)C12

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
GMNN O75496 1/20 0.40
PPM1B O75688 1/20 0.40
LMNA P02545 1/20 0.40
PPP1CC P36873 1/20 0.40
TFPI2 P48307 1/20 0.40
RAB9A P51151 1/20 0.40
PPP5C P53041 1/20 0.40
PPP1CA P62136 1/20 0.40
PMP22 Q01453 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 1/20 0.40
CYP2D6 P10635 1/20 0.40
NFKB1 P19838 1/20 0.40
THPO P40225 1/20 0.40
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL14297393 1.00 KDM4E (0.40) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL15451887 0.91 SMN1; SMN2 (0.42) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL19057999 0.91 SMN1; SMN2 (0.42) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL671860 0.91 SMN1; SMN2 (0.42) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL23139797 0.91 SMN1; SMN2 (0.42) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL17035536 0.86 KDM4E (0.39) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL2334133 0.83 SMN1; SMN2 (0.37) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL14216716 0.81 KDM4E (0.36) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL14197579 0.81 KDM4E (0.36) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL7869972 0.81 KDM4E (0.36) KDM4EGMNNPPM1BLMNAPPP1CC

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024130540-A1 ELECTROLYTE, ELECTROCHEMICAL DEVICE, AND ELECTRONIC DEVICE 东莞新能源科技有限公司 2024-06-27 WO disclosed
US-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-24 US disclosed
EP-4180434-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Sichuan Haisco Pharmaceutical Co., Ltd. (CN) 2023-05-17 EP disclosed
WO-2022007966-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川海思科制药有限公司 2022-01-13 WO disclosed
US-8552183-B2 Process for the covalent coupling of two molecules by means of a diels-alder reaction with inverse electron requirement DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2013-10-08 US disclosed
US-8552183-B2 Process for the covalent coupling of two molecules by means of a diels-alder reaction with inverse electron requirement DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2013-10-08 US disclosed
US-20100016545-A1 PROCESS FOR THE COVALENT COUPLING OF TWO MOLECULES BY MEANS OF A DIELS-ALDER REACTION WITH INVERSE ELECTRON REQUIREMENT DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2010-01-21 US disclosed
WO-2007144200-A1 PROCESS FOR THE COVALENT COUPLING OF TWO MOLECULES BY MEANS OF A DIELS-ALDER REACTION WITH INVERSE ELECTRON REQUIREMENT Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2007-12-21 WO disclosed
EP-1867638-A1 Procedure for the Conection of two Molecules via Diels-Alder Reactions with Inverse Electron Demand Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2007-12-19 EP disclosed
US-5221745-A Antidepressanat, anxiolytic and hypotensive agent AMERICAN HOME PRODUCTS CORP. (US) 1993-06-22 US disclosed
US-5212170-A Psychotropic piperidinylmethyl benzodioxans AMERICAN HOME PRODUCTS CORPORATION (US) 1993-05-18 US disclosed
US-5182292-A Psychotropic piperidinylmethyl benzodioxans AMERICAN HOME PRODUCTS CORPORATION (US) 1993-01-26 US disclosed
US-5134140-A Psychotropic benzofuran derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1992-07-28 US disclosed
US-4968792-A Psychotropic benzisothiazole derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1990-11-06 US disclosed
US-4910302-A Dehydro-3-(2-(2,3-dihydro-1,4-benzdioxan-2-ylmethyl)amino)-ethyl)-1,5-methano-6,7,9-metheno-2H-pentaleno(1,2-d)-azepine-2,4-3H-dione AMERICAN HOME PRODUCTS CORPORATION (US) 1990-03-20 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 (2 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-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP11B2, WEE2, CYP11B1 KDM4E 4592/4885GMNN 4713/4885PPM1B 301/4885
US-20100016545-A1 PROCESS FOR THE COVALENT COUPLING OF TWO MOLECULES BY MEANS OF A DIELS-ALDER REACTION WITH INVERSE ELECTRON REQUIREMENT CX3CR1, NR3C2, NR4A2 KDM4E 4605/4885GMNN 3850/4885PPM1B 2727/4885

“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.