SCHEMBL8073017

SCHEMBL8073017

C=CCCCCCCCc1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.48
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TLR8 Q9NR97 1/20 0.43
MPO P05164 3/20 0.41
AOC3 Q16853 1/20 0.41
HDAC1 Q13547 2/20 0.39
SLC6A4 P31645 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
IDO1 P14902 2/20 0.37
LMNA P02545 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
SCHEMBL8077496 1.00 TAAR1 (0.48) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8072473 1.00 TAAR1 (0.48) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8072559 1.00 TAAR1 (0.48) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8072160 0.98 TAAR1 (0.50) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8063273 0.92 TAAR1 (0.52) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL7563209 0.84 TAAR1 (0.56) TAAR1ALDH1A1HPGDMPOAOC3
SCHEMBL863377 0.79 TAAR1 (0.54) TAAR1HPGDMPOAOC3SLC6A4
SCHEMBL8062475 0.78 TSHR (0.48) USP2ALDH1A1HPGDTDP1TLR8
SCHEMBL8071303 0.78 TAAR1 (0.47) TAAR1USP2ALDH1A1HPGDTDP1
SCHEMBL8073188 0.78 TSHR (0.54) USP2ALDH1A1HPGDTDP1TLR8

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