SCHEMBL254583

SCHEMBL254583

COOCc1ccccc1-c1ccc(CBr)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.41
FFAR4 Q5NUL3 12/20 0.41
TRPA1 O75762 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
TACR1 P25103 1/20 0.35
DPP4 P27487 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
ABL1 P00519 1/20 0.32
ABCB1 P08183 1/20 0.32
BCR P11274 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32

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
SCHEMBL254119 0.86 FFAR1 (0.43) FFAR1FFAR4TRPA1ALDH1A1TSHR
SCHEMBL1309773 0.79 ALDH1A1 (0.48) FFAR1FFAR4TRPA1ALDH1A1TSHR
SCHEMBL809767 0.75 TRPA1 (0.44) FFAR1FFAR4TRPA1ALDH1A1TSHR
SCHEMBL10892045 0.74 ALDH1A1 (0.57) TRPA1ALDH1A1TSHRDPP4ABL1
SCHEMBL809887 0.74 DPP4 (0.64) TRPA1ALDH1A1TSHRDPP4CES2
SCHEMBL1338590 0.74 FFAR1 (0.46) FFAR1FFAR4TACR1DPP4
SCHEMBL8266911 0.74 CYP4F2 (0.44) FFAR1FFAR4PPARGPPARACES2
SCHEMBL4966768 0.73 NAAA (0.49) PPARGPPARA
SCHEMBL10296086 0.71 CA12 (0.42) FFAR1FFAR4PPARGPPARA
SCHEMBL9023806 0.70 ALDH1A1 (0.59) TRPA1ALDH1A1TSHRDPP4PPARG

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