SCHEMBL8070935

SCHEMBL8070935

CCc1ccccc1CCCCCCCCCBr

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.44
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
BID P55957 3/20 0.38
MCL1 Q07820 3/20 0.38
BCL2L1 Q07817 2/20 0.38
BAK1 Q16611 2/20 0.38
KAT8 Q9H7Z6 2/20 0.38
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
SLC16A3 O15427 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
EP300 Q09472 1/20 0.38
KAT2A Q92830 1/20 0.38
KAT2B Q92831 1/20 0.38

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
SCHEMBL8063382 1.00 LIPG (0.44) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL8072346 1.00 LIPG (0.44) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL8077993 1.00 LIPG (0.44) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL8076166 1.00 LIPG (0.44) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL8073120 1.00 LIPG (0.44) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL8077715 0.98 CYP4F2 (0.45) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL8062014 0.91 GABRA1 (0.44) LIPGCYP4F2CYP4A11GABRA1GABRB2
SCHEMBL9860715 0.89 LIPG (0.42) LIPGCYP4F2CYP4A11NR1H2NR1H3
SCHEMBL2177804 0.89 LIPG (0.42) LIPGCYP4F2CYP4A11NR1H2NR1H3
SCHEMBL8062377 0.88 LIPG (0.53) LIPGCYP4F2CYP4A11NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed
US-5637736-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-10 US disclosed
EP-0637580-A1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-08 EP disclosed