SCHEMBL2633409

SCHEMBL2633409

COC(=O)c1ccc2c(c1)CCCC2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
CA12 O43570 3/20 0.52
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
CA14 Q9ULX7 3/20 0.52
XDH P47989 1/20 0.52
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
ATM Q13315 2/20 0.51
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
HTT P42858 2/20 0.48
HPGD P15428 2/20 0.48
GAA P10253 2/20 0.48
HSP90AA1 P07900 1/20 0.48
SMYD3 Q9H7B4 1/20 0.48

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
SCHEMBL31544703 1.00 ALDH1A1 (0.56) ALDH1A1NPC1RAB9ACA12CA1
SCHEMBL22916696 0.98 ALDH1A1 (0.55) ALDH1A1NPC1RAB9ACA12CA1
SCHEMBL10118342 0.98 ALDH1A1 (0.55) ALDH1A1NPC1RAB9ACA12CA1
SCHEMBL883530 0.96 ALDH1A1 (0.61) ALDH1A1NPC1RAB9ACA12CA1
SCHEMBL9644030 0.92 CA1 (0.55) ALDH1A1CA12CA1CA2CA7
SCHEMBL2729577 0.86 DRD2 (0.47) ALDH1A1NPC1RAB9ACA12CA1
SCHEMBL27357789 0.85 ALDH1A1 (0.60) ALDH1A1NPC1RAB9AKMT2AMEN1
SCHEMBL12608358 0.84 HDAC6 (0.50) ALDH1A1NPC1RAB9ACA12CA1
SCHEMBL1263166 0.84 MELK (0.50) ALDH1A1CA12CA1CA2CA7
SCHEMBL6884515 0.83 ALDH1A1 (0.58) ALDH1A1NPC1RAB9AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10043978-B2 Organic semiconductor formulations FLEXTERRA, INC. (US) 2018-08-07 US claimed
US-20170012208-A1 ORGANIC SEMICONDUCTOR FORMULATIONS USINVEST LLC 2017-01-12 US claimed
EP-0666250-B1 Derivatives of N-(3-aminopropyl)-N-phenyl-5,6,7,8-tetrahydronaphthalene-2-carboxamide having neuroprotective and anti-ischemic properties, their preparation and their use, in therapy SYNTHELABO (FR) 1998-02-11 EP claimed
EP-0582506-B1 Tetrahydronaphtalene derivatives, their preparation and their application in therapy SYNTHELABO (FR) 1996-02-28 EP claimed
JP-6172282-A None JP disclosed
EP-4257588-A1 SMALL MOLECULE INHIBITOR OF CATHEPSIN C AND MEDICINAL USE THEREOF Reistone Biopharma Company Limited (CN) 2023-10-11 EP disclosed
WO-2022117059-A1 SMALL MOLECULE INHIBITOR OF CATHEPSIN C AND MEDICINAL USE THEREOF 瑞石生物医药有限公司 2022-06-09 WO disclosed
US-10043978-B2 Organic semiconductor formulations FLEXTERRA, INC. (US) 2018-08-07 US disclosed
US-20170012208-A1 ORGANIC SEMICONDUCTOR FORMULATIONS USINVEST LLC 2017-01-12 US disclosed
US-9387203-B2 Substituted aminoindane- and aminotetralinecarboxylic acids and the use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-07-12 US disclosed
US-9293711-B2 Organic semiconductor formulations POLYERA CORPORATION (US) 2016-03-22 US disclosed
US-9290485-B2 N-((6-amino-pyridin-3-yl)methyl)-heteroaryl-carboxamides NOVARTIS AG (CH) 2016-03-22 US disclosed
EP-1205478-A1 p38MAP KINASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2002-05-15 EP disclosed
US-5663183-A CEREBRAL DISORDERS SYNTHELABO (FR) 1997-09-02 US disclosed
US-5550162-A TREATMENT AND PREVENTION OF CEREBRAL DISORDERS SYNTHELABO (FR) 1996-08-27 US disclosed
US-5373023-A Antiischaemic agent SYNTHELABO (FR) 1994-12-13 US disclosed
JP-H06172282-A TETRAHYDRONAPHTHALENE DERIVATIVE, ITS PREPARATION AND ITS USE IN MEDICAL TREATMENT SYNTHELABO SA 1994-06-21 JP disclosed
EP-0149884-B1 5-PYRIDYL-1,3-THIAZOLE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-12-16 EP disclosed
US-4612321-A 5-pyridyl-1,3-thiazole derivatives TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 1986-09-16 US disclosed
EP-0149884-A2 5-Pyridyl-1,3-thiazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1985-07-31 EP disclosed