SCHEMBL8072076

SCHEMBL8072076

CCCCc1ccccc1CCCCCCCCBr

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.53
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
KAT8 Q9H7Z6 2/20 0.41
THRA P10827 2/20 0.41
THRB P10828 2/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
KAT5 Q92993 1/20 0.41
SAE1 Q9UBE0 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL8076483 1.00 LIPG (0.53) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8063268 1.00 LIPG (0.53) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8073230 1.00 LIPG (0.53) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8062377 1.00 LIPG (0.53) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8072466 1.00 LIPG (0.53) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8072142 0.98 LIPG (0.50) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8070963 0.92 LIPG (0.48) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8062186 0.92 LIPG (0.48) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8078014 0.92 LIPG (0.48) LIPGNR1H2NR1H3BIDMCL1
SCHEMBL8076376 0.92 LIPG (0.48) LIPGNR1H2NR1H3BIDMCL1

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