SCHEMBL8070905

SCHEMBL8070905

C=CCCCCCCCc1ccccc1I

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.47
TDP1 Q9NUW8 2/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TLR8 Q9NR97 1/20 0.40
HDAC1 Q13547 2/20 0.39
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 2/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 1/20 0.34
LIPG Q9Y5X9 1/20 0.33

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
SCHEMBL8062887 1.00 TAAR1 (0.47) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL8072631 1.00 TAAR1 (0.47) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL8073043 1.00 TAAR1 (0.47) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL8072123 0.98 TAAR1 (0.48) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL8073132 0.92 TAAR1 (0.50) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL248640 0.84 TAAR1 (0.54) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL96183 0.81 TAAR1 (0.47) TAAR1EP300KAT2BKAT5KAT8
SCHEMBL9098696 0.79 TAAR1 (0.52) TAAR1IDO1THRATHRBLIPG
SCHEMBL8070767 0.78 TAAR1 (0.47) TAAR1TDP1USP2ALDH1A1HPGD
SCHEMBL8076178 0.78 TSHR (0.54) TDP1USP2ALDH1A1HPGDTLR8

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