SCHEMBL254119

SCHEMBL254119

CCOOCc1ccccc1-c1ccc(CBr)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.43
FFAR4 Q5NUL3 12/20 0.43
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
TACR1 P25103 1/20 0.35
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
DPP4 P27487 1/20 0.33
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31
CSNK2A3 Q8NEV1 1/20 0.31

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
SCHEMBL254583 0.86 FFAR1 (0.41) FFAR1FFAR4TRPA1ALDH1A1TSHR
SCHEMBL1309773 0.77 ALDH1A1 (0.48) FFAR1FFAR4TRPA1ALDH1A1TSHR
SCHEMBL7706546 0.75 TRPA1 (0.39) TRPA1ALDH1A1TSHR
SCHEMBL809767 0.74 TRPA1 (0.44) FFAR1FFAR4TRPA1ALDH1A1TSHR
SCHEMBL1338113 0.73 TACR1 (0.48) FFAR1FFAR4TSHRLTB4R2TACR1
SCHEMBL10892045 0.73 ALDH1A1 (0.57) TRPA1ALDH1A1TSHRDPP4CSNK2A1
SCHEMBL809887 0.73 DPP4 (0.64) TRPA1ALDH1A1TSHRDPP4CSNK2A2
SCHEMBL1967796 0.70 FFAR1 (0.41) FFAR1FFAR4LTB4R2PPARADPP4
SCHEMBL8266911 0.70 CYP4F2 (0.44) FFAR1FFAR4PPARAPPARG
SCHEMBL9023806 0.69 ALDH1A1 (0.59) TRPA1ALDH1A1TSHRPPARAPPARG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012028925-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF TELMISARTAN OGENE SYSTEMS (I) PVT LTD (IN) 2012-03-08 WO disclosed