SCHEMBL2774096

SCHEMBL2774096

C#Cc1ccccc1CCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.50
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
ALOX5 P09917 1/20 0.41
PTGS2 P35354 1/20 0.41
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
TLR8 Q9NR97 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL2350389 0.98 LIPG (0.53) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL31529667 0.98 LIPG (0.53) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL668402 0.94 LIPG (0.43) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL2152995 0.86 CYP2E1 (0.38) LIPG
SCHEMBL7966476 0.81 LIPG (0.50) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL1584216 0.81 LIPG (0.50) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL6113910 0.81 LIPG (0.50) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL978626 0.81 LIPG (0.50) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL2353501 0.80 NR1H2 (0.39) LIPGNR1H2NR1H3ALOX5PTGS2
SCHEMBL27932474 0.80 LIPG (0.36) LIPGBIDMCL1BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9920160-B2 Method for synthesis of polymer containing multiple epoxy groups ZHEJIANG UNIVERSITY (CN) 2018-03-20 US claimed
US-20170044304-A1 Method for synthesis of polymer containing multiple epoxy groups UNIV ZHEJIANG (CN) 2017-02-16 US claimed
EP-0041476-B1 ARYL-PHENYL-ACETYLENE COMPOUNDS CIBA-GEIGY AG (CH) 1985-07-24 EP claimed
CN-108822869-B Chlorine-containing liquid crystal compound, composition thereof and high-frequency assembly comprising chlorine-containing liquid crystal compound 西安近代化学研究所 2022-10-25 CN disclosed
US-9920160-B2 Method for synthesis of polymer containing multiple epoxy groups ZHEJIANG UNIVERSITY (CN) 2018-03-20 US disclosed
US-20170044304-A1 Method for synthesis of polymer containing multiple epoxy groups UNIV ZHEJIANG (CN) 2017-02-16 US disclosed
US-7777218-B1 Memory cell containing copolymer containing diarylacetylene portion SPANSION LLC (US) 2010-08-17 US disclosed
US-7105374-B1 Memory cell containing copolymer containing diarylacetylene portion SPANSION LLC (US) 2006-09-12 US disclosed
EP-1513205-A2 Light emitting device Kabushiki Kaisha Toyota Jidoshokki (JP) 2005-03-09 EP disclosed
US-20050046336-A1 Light emitting device KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2005-03-03 US disclosed
US-4412856-A POSTERMERGENCE HERBICIDES CIBA-GEIGY CORPORATION (US) 1983-11-01 US disclosed