SCHEMBL4885485

SCHEMBL4885485

c1ccc(NC2CCCNC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.54
MAOB P27338 1/20 0.54
IDH2 P48735 1/20 0.48
PRKCZ Q05513 5/20 0.47
PRKD2 Q9BZL6 3/20 0.47
CHEK2 O96017 3/20 0.47
HTR6 P50406 4/20 0.46
CHEK1 O14757 1/20 0.43
KCNH2 Q12809 1/20 0.43

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
SCHEMBL3801837 1.00 KDM1A (0.54) KDM1AMAOBIDH2PRKCZPRKD2
SCHEMBL24699318 1.00 KDM1A (0.54) KDM1AMAOBIDH2PRKCZPRKD2
SCHEMBL17961734 0.89 KDM1A (0.51) KDM1AMAOBIDH2CHEK2HTR6
SCHEMBL2343007 0.89 KDM1A (0.51) KDM1AMAOBIDH2CHEK2HTR6
Hydrochloric Acid SCHEMBL14862165 0.87 KDM1A (0.50) KDM1AMAOBIDH2CHEK2HTR6
Hydrochloric Acid SCHEMBL32664670 0.87 KDM1A (0.50) KDM1AMAOBIDH2CHEK2HTR6
SCHEMBL4965283 0.85 CHEK2 (0.47) KDM1AMAOBCHEK2HTR6
SCHEMBL27178730 0.84 PRKCZ (0.43) KDM1AMAOBIDH2PRKCZHTR6
SCHEMBL24596919 0.82 FPR2 (0.54) KDM1AMAOBIDH2PRKCZHTR6
SCHEMBL661039 0.82 PRKCZ (0.55) IDH2PRKCZPRKD2CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119569641-A Synthesis method of nilaparib intermediate 4- (piperidin-3-yl) aniline 山东铂源药业股份有限公司 2025-03-07 CN claimed
CN-119569641-A Synthesis method of nilaparib intermediate 4- (piperidin-3-yl) aniline 山东铂源药业股份有限公司 2025-03-07 CN disclosed
CN-119569641-A Synthesis method of nilaparib intermediate 4- (piperidin-3-yl) aniline 山东铂源药业股份有限公司 2025-03-07 CN disclosed
CN-119569641-A Synthesis method of nilaparib intermediate 4- (piperidin-3-yl) aniline 山东铂源药业股份有限公司 2025-03-07 CN disclosed
EP-2900666-B1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECH LTD (GB) 2020-11-04 EP disclosed
US-9914730-B2 Azaquinazoline inhibitors of Atypical protein Kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-03-13 US disclosed
US-9896446-B2 Azaquinazoline inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-02-20 US disclosed
US-20160102094-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C IGNYTA, INC. (US) 2016-04-14 US disclosed
EP-2900666-A1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C Ignyta, Inc. (US) 2015-08-05 EP disclosed
WO-2014052699-A9 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C IGNYTA, INC. (US) 2015-07-16 WO disclosed
CN-102675280-B Trifluoromethyl-containing indole ketone compound,and preparation method and application thereof SHANGHAI INST ORGANIC CHEM 2015-01-14 CN disclosed
US-20140113882-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2014-04-24 US disclosed
US-20080176883-A1 Antiinflammtory, antiproliferative, anticancer agents; (3-Hydroxy-pyrrolidin-1-yl)-(3-trifluoromethyl-7,8-dihydro-5H-[1,6]naphthyridin-6-yl)-methanone ABBVIE INC. 2008-07-24 US disclosed
US-5292738-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-08 US disclosed
US-5157035-A Viricides JANSSEN PHARMACEUTICA N. V. (BE) 1992-10-20 US disclosed
US-5001125-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-03-19 US disclosed
EP-0156433-B1 ANTI-VIRALLY ACTIVE PYRIDAZINAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1991-02-27 EP disclosed
US-4798897-A (AMINOALKYL)AMINOSULFONYL-SUBSTITUTED CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1989-01-17 US disclosed
EP-0156433-A2 Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1985-10-02 EP 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 (3 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-20080176883-A1 Antiinflammtory, antiproliferative, anticancer agents; (3-Hydroxy-pyrrolidin-1-yl)-(3-trifluoromethyl-7,8-dihydro-5H-[1,6]naphthyridin-6-yl)-methanone MIF, CCL5, CCR2 KDM1A 3702/4885MAOB 3552/4885IDH2 2541/4885
US-20160102094-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C PRKCQ, PRKCZ, PRKCE KDM1A 1114/4885MAOB 4396/4885IDH2 3600/4885
US-20140113882-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C PRKCQ, PRKCZ, PRKCE KDM1A 1175/4885MAOB 4418/4885IDH2 3420/4885

“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.