SCHEMBL1780397

SCHEMBL1780397

C=Cc1cc(CCCC)cc(CCCC)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.45
NPC1 O15118 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PTGS2 P35354 3/20 0.42
CYP3A4 P08684 1/20 0.42
THRB P10828 6/20 0.42
THRA P10827 5/20 0.42
GPR84 Q9NQS5 2/20 0.41
SKP2 Q13309 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL16954781 0.96 NPC1 (0.42) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL16962598 0.94 NPC1 (0.41) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL12802256 0.94 PTGS2 (0.50) PTGS2CYP3A4THRBTHRAGPR84
SCHEMBL12802058 0.92 PTGS2 (0.52) PTGS2CYP3A4THRBTHRAGPR84
SCHEMBL21698715 0.92 PTGS2 (0.52) PTGS2CYP3A4THRBTHRAGPR84
SCHEMBL16957424 0.88 NPC1 (0.44) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL16959544 0.87 NPC1 (0.39) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL16958985 0.87 NPC1 (0.39) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL16960722 0.87 NPC1 (0.39) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL1264504 0.86 THRB (0.38) HPGDNPC1MAPK1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119552323-A Copolymer microgel latex, preparation method and application thereof 中国石油化工股份有限公司 2025-03-04 CN claimed
US-20240262940-A1 HYDROGENATION METHOD FOR AROMATIC POLYMER AND HYDROGENATED BLOCK COPOLYMER AND USE THEREOF Sinopec (Beijing) Research Institute of Chemical Industry Co., Ltd. (CN) 2024-08-08 US claimed
CN-114057937-B Conjugated diene polymer, preparation method and application thereof, and styrene-butadiene rubber 中国石油化工股份有限公司 2024-06-04 CN claimed
CN-118047919-A Monovinylarene and conjugated diene block copolymer composition, preparation method and application thereof 中国石油化工股份有限公司 2024-05-17 CN claimed
CN-118047997-A Dynamically vulcanized thermoplastic elastomer material composition, application thereof and dynamically vulcanized thermoplastic elastomer material 中国石油化工股份有限公司 2024-05-17 CN claimed
CN-115785525-B Structure regulator composition, liquid terpolymer, preparation method and application thereof 中国石油化工股份有限公司 2024-03-26 CN claimed
EP-4324857-A1 HYDROGENATION METHOD FOR AROMATIC POLYMER AND HYDROGENATED BLOCK COPOLYMER AND USE THEREOF China Petroleum & Chemical Corporation (CN) 2024-02-21 EP claimed
CN-114057949-B Conjugated diene polymer, preparation method and application thereof, and styrene-butadiene rubber 中国石油化工股份有限公司 2024-02-13 CN claimed
CN-117143301-A Monovinylarene-conjugated diene polymer, preparation method and application thereof 中国石油化工股份有限公司 2023-12-01 CN claimed
CN-117143302-A Monovinylarene-conjugated diene polymer, preparation method and application thereof 中国石油化工股份有限公司 2023-12-01 CN claimed
CN-102453304-B Monovinylarene-conjugated diene block copolymer composition and preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2013-07-03 CN claimed
CN-102108114-B Impact-resistant transparent linear asymmetric block copolymer of vinyl aromatic hydrocarbon and conjugated diene and preparation method of block copolymer CHINA PETROLEUM & CHEMICAL 2013-04-17 CN claimed
CN-102372823-B Terpolymer rubber with medium/high side group content and preparation method and applications thereof CHINA PETROLEUM & CHEMICAL 2012-12-19 CN claimed
CN-101962423-B Method for preparing ternarypolymerization rubber and application thereof CHINA PETROLEUM & CHEMICAL 2012-11-28 CN claimed
CN-102453216-A Terpolymer of conjugated diene and monovinyl aromatic hydrocarbon, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2012-05-16 CN claimed
CN-102372823-A Terpolymer rubber with medium/high side group content and preparation method and applications thereof CHINA PETROLEUM & CHEMICAL 2012-03-14 CN claimed
CN-102108114-A Impact-resistant transparent linear asymmetric block copolymer of vinyl aromatic hydrocarbon and conjugated diene and preparation method of block copolymer CHINA PETROLEUM & CHEMICAL 2011-06-29 CN claimed
CN-101962423-A Method for preparing ternarypolymerization rubber and application thereof CHINA PETROLEUM & CHEMICAL 2011-02-02 CN claimed
CN-101255223-B Terpolymer rubber having low rolling resistance and high wet-sliding resistant performance, preparation and uses thereof CHINA PETROCHEMICAL CORP 2010-12-01 CN claimed
CN-101255223-A Terpolymer rubber having low rolling resistance and high wet-sliding resistant performance, preparation and uses thereof CHINA PETROCHEMICAL CORP (CN) 2008-09-03 CN claimed