SCHEMBL487963

SCHEMBL487963

NC(=O)c1ccccc1CCN1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
KDM4E B2RXH2 2/20 0.56
PARP1 P09874 2/20 0.53
PARP2 Q9UGN5 2/20 0.53
TSHR P16473 1/20 0.50
KMT2A Q03164 4/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.46
CYP2C19 P33261 1/20 0.46
POLB P06746 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
MEN1 O00255 2/20 0.44

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
SCHEMBL16462030 0.95 ALDH1A1 (0.51) ALDH1A1KDM4EPARP1PARP2TSHR
SCHEMBL1385121 0.92 PARP1 (0.54) ALDH1A1KDM4EPARP1PARP2TSHR
SCHEMBL18108811 0.87 PARP1 (0.53) ALDH1A1KDM4EPARP1PARP2TSHR
SCHEMBL7527733 0.87 PARP1 (0.53) ALDH1A1KDM4EPARP1PARP2KMT2A
SCHEMBL6043506 0.87 ALDH1A1 (0.55) ALDH1A1TSHRKMT2AMAPTLMNA
SCHEMBL1381548 0.86 HRH3 (0.58) ALDH1A1PARP1PARP2KMT2ASIGMAR1
SCHEMBL2154542 0.85 POLB (0.45) ALDH1A1KDM4EPARP1PARP2TSHR
SCHEMBL4502911 0.85 HRH3 (0.57) ALDH1A1PARP1PARP2KMT2AMAPT
SCHEMBL2228234 0.85 KDM4E (0.58) ALDH1A1KDM4EPARP1PARP2KMT2A
Hydrochloric Acid SCHEMBL8521067 0.84 ALDH1A1 (0.50) ALDH1A1TSHRKMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4274825-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF Genosco Inc. (US) 2023-11-15 EP claimed
WO-2022150381-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF Genosco Inc. (US) 2022-07-14 WO claimed
EP-3898631-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. Hoffmann-La Roche AG (CH) 2021-10-27 EP claimed
WO-2020126953-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 WO claimed
EP-2885284-A1 PYRAZOLYL-UREAS AS KINASE INHIBITORS Respivert Limited (GB) 2015-06-24 EP claimed
WO-2014027209-A1 PYRAZOLYL-UREAS AS KINASE INHIBITORS RESPIVERT LIMITED (GB) 2014-02-20 WO claimed
JP-4695588-B2 2011-06-08 JP claimed
JP-2006519232-A 2006-08-24 JP claimed
EP-1603570-A2 AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS Sugen, Inc. (US) 2005-12-14 EP claimed
WO-2004076412-A2 AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS SUGEN, INC. (US) 2004-09-10 WO claimed
EP-1112251-B1 AZETIDINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM AVENTIS PHARMA SA (FR) 2003-05-07 EP claimed
JP-2002532415-A 2002-10-02 JP claimed
EP-1143957-A3 TREATMENT OF ARTHRITIS WITH MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-02-27 EP claimed
EP-1143957-A2 TREATMENT OF ARTHRITIS WITH MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-10-17 EP claimed
EP-1140062-A2 TREATMENT OF ASTHMA WITH MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-10-10 EP claimed
WO-2000040235-A2 TREATMENT OF ASTHMA WITH MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-07-13 WO claimed
WO-2000035436-A2 TREATMENT OF ARTHRITIS WITH MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-06-22 WO claimed
WO-1998037881-A1 METHOD OF TREATING OR PREVENTING SEPTIC SHOCK BY ADMINISTERING A MEK INHIBITOR WARNER LAMBERT COMPANY (US) 1998-09-03 WO claimed
EP-4735113-A1 PYRAZOLE DERIVATIVES AS PD-1/PD-L1 INTERACTION INHIBITORS Institut National de la Santé et de la Recherche Médicale (FR) 2026-05-06 EP disclosed
US-6310060-B1 FOR USE AS ANTIPROLIFERATIVE AGENT FOR USE AGAINST CANCER, PSORIASIS, RESTENOSIS, AUTOIMMUNE DISEASE, OR ATHEROSCLEROSIS WARNER-LAMBERT COMPANY 2001-10-30 US disclosed