SCHEMBL60671

SCHEMBL60671

c1ccc(C2CCCCC2)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MAPK1 P28482 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TP53 P04637 1/20 0.50
KDM4E B2RXH2 4/20 0.49
CYP1A2 P05177 2/20 0.46
GRM5 P41594 1/20 0.46
GAA P10253 1/20 0.45
MAPT P10636 2/20 0.44
LMNA P02545 2/20 0.43
HSD17B10 Q99714 1/20 0.43
KMT2A Q03164 2/20 0.42
CYP11B2 P19099 1/20 0.42
POLB P06746 1/20 0.42
CCR1 P32246 1/20 0.42
CCR5 P51681 1/20 0.42
CCR8 P51685 1/20 0.42
METAP1 P53582 1/20 0.42

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
SCHEMBL29742299 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL29507617 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL29507637 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL29743227 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL29743225 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL30853689 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL29742285 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL2056505 1.00 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL618578 0.98 ALDH1A1 (0.49) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL1481510 0.98 ALDH1A1 (0.50) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2

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 1153 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11814563-B2 Bioreachable chiral dopants for liquid crystal applications ZYMERGEN INC. (US) 2023-11-14 US claimed
US-20230203378-A1 FORMULATIONS OF BIOREACHABLE DOPANTS FOR LIQUID CRYSTALS KENT STATE UNIVERSITY 2023-06-29 US claimed
EP-4116293-A2 RHO KINASE INHIBITORS Kadmon Corporation, LLC (US) 2023-01-11 EP claimed
CN-114573566-A Selective ROCK2 kinase inhibitors 杭州邦顺制药有限公司 2022-06-03 CN claimed
WO-2022042666-A1 SELECTIVE ROCK2 KINASE INHIBITOR 杭州邦顺制药有限公司 2022-03-03 WO claimed
CN-114105976-A Selective ROCK2 kinase inhibitors 杭州邦顺制药有限公司 2022-03-01 CN claimed
US-20220025267-A1 BIOREACHABLE CHIRAL DOPANTS FOR LIQUID CRYSTAL APPLICATIONS ZYMERGEN ACQUISITION SUB, INC. 2022-01-27 US claimed
CN-113773308-A RHO kinase inhibitors 卡德门企业有限公司 2021-12-10 CN claimed
CN-113637007-A RHO kinase inhibitors 卡德门企业有限公司 2021-11-12 CN claimed
CN-113637008-A RHO kinase inhibitors 卡德门企业有限公司 2021-11-12 CN claimed
US-6602562-B2 High dielectric anisotropy and clearing point with little impact on voltage holding ratio, low temperature stability and response time MERCK PATENT GESELLSCHAFT MIT (DE) 2003-08-05 US claimed
EP-1322601-A1 METHOD FOR SULPHONYLATING A HYDROXYLATED ORGANIC COMPOUND Rhodia Chimie (FR) 2003-07-02 EP claimed
US-20030113482-A1 Realignment layer; field has a component parallel to the liquid-crystal layer; positive dielectric anisotropy MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2003-06-19 US claimed
CN-1420382-A Liquid crystal display contg. chiral dopant MERCK PATENT GMBH (DE) 2003-05-28 CN claimed
WO-2002028826-A1 METHOD FOR SULPHONYLATING A HYDROXYLATED ORGANIC COMPOUND RHODIA CHIMIE (FR) 2002-04-11 WO claimed
US-6217792-B1 Chiral dopants MERCK PATENT GMBH (DE) 2001-04-17 US claimed
WO-1999042424-A1 METHOD FOR PREPARING AROMATIC KETONE COMPOUNDS RHODIA CHIMIE (FR) 1999-08-26 WO claimed
EP-0408995-B1 Liquid crystal medium with limited temperature-dependence of the d/p coefficient MERCK PATENT GMBH (DE) 1995-11-08 EP claimed
US-5139698-A Achiral liquid crystal compound with doping component MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-08-18 US claimed
EP-0408995-A2 Liquid crystal medium with limited temperature-dependence of the d/p coefficient MERCK PATENT GmbH (DE) 1991-01-23 EP claimed