SCHEMBL8078262

SCHEMBL8078262

C=CCCCCCCCc1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.47
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CHRM2 P08172 1/20 0.41
TLR8 Q9NR97 1/20 0.40
TSHR P16473 1/20 0.39
HDAC1 Q13547 2/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
HDAC4 P56524 1/20 0.38
EP300 Q09472 1/20 0.38
KAT2B Q92831 1/20 0.38
KAT5 Q92993 1/20 0.38
KAT8 Q9H7Z6 1/20 0.38
LIPG Q9Y5X9 1/20 0.37
GPR84 Q9NQS5 1/20 0.36
LMNA P02545 1/20 0.35
SLC16A3 O15427 1/20 0.35

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
SCHEMBL8077854 1.00 TAAR1 (0.47) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8070767 1.00 TAAR1 (0.47) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL9241987 1.00 TAAR1 (0.47) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8073131 0.98 TAAR1 (0.48) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL1875865 0.92 TAAR1 (0.50) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL29779783 0.92 TAAR1 (0.50) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL9244061 0.89 HDAC1 (0.43) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL1240981 0.84 TAAR1 (0.54) TAAR1ALDH1A1CHRM2TSHRGPR84
SCHEMBL8096637 0.84 TAAR1 (0.62) TAAR1CHRM2TSHRLIPGGPR84
SCHEMBL8094982 0.84 TAAR1 (0.62) TAAR1CHRM2TSHRLIPGGPR84

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