SCHEMBL22668014

SCHEMBL22668014

C=CCO/N=C(\COc1ccc(COc2ccc(CCC=O)cc2)cc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.46
BCHE P06276 3/20 0.42
FFAR4 Q5NUL3 2/20 0.40
PLA2G4B P0C869 1/20 0.39
LTA4H P09960 1/20 0.38
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
DRD4 P21917 1/20 0.37
NR4A1 P22736 1/20 0.37
NR4A2 P43354 1/20 0.37
NR4A3 Q92570 1/20 0.37

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
SCHEMBL15239057 0.88 FFAR1 (0.57) FFAR1FFAR4
SCHEMBL10267355 0.88 FFAR1 (0.57) FFAR1FFAR4
SCHEMBL22668554 0.85 FFAR1 (0.62) FFAR1BCHEFFAR4PLA2G4BLTA4H
SCHEMBL10267354 0.80 FFAR1 (0.60) FFAR1PLA2G4BALDH1A1HTTSMN1; SMN2
SCHEMBL15239360 0.80 FFAR1 (0.60) FFAR1PLA2G4BALDH1A1HTTSMN1; SMN2
SCHEMBL15239382 0.80 FFAR1 (0.60) FFAR1PLA2G4BALDH1A1HTTSMN1; SMN2
SCHEMBL2772725 0.75 FFAR1 (0.61) FFAR1BCHEFFAR4LTA4HEPHX2
SCHEMBL10259737 0.75 FFAR1 (0.67) FFAR1FFAR4PPARGPPARA
SCHEMBL15239252 0.75 FFAR1 (0.67) FFAR1FFAR4PPARGPPARA
SCHEMBL22668047 0.74 FFAR1 (0.52) FFAR1BCHEFFAR4PLA2G4BLTA4H

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
EP-2595952-B1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-11-18 EP disclosed