SCHEMBL8077937

SCHEMBL8077937

Cc1ccccc1CCCCCCCCBr

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.52
CHRM2 P08172 2/20 0.44
LIPG Q9Y5X9 1/20 0.40
SLC16A3 O15427 1/20 0.38
DAO P14920 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP19A1 P11511 1/20 0.36
TSHR P16473 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL8070942 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8063050 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8072709 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8072451 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8076478 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8070918 0.98 TAAR1 (0.54) TAAR1CHRM2LIPGDAOCA12
SCHEMBL80278 0.91 TAAR1 (0.56) TAAR1CHRM2DAOCA12CA1
SCHEMBL8103734 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8094982 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8086316 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO

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