SCHEMBL22668115

SCHEMBL22668115

CC(=N)/C(=C(/C)O)C(CC(=O)O)c1ccc(OCc2ccc(OCC(=N)c3ccccc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 14/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAOB P27338 1/20 0.43
MMP12 P39900 1/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
PPARG P37231 1/20 0.42

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
SCHEMBL22668106 0.86 MMP9 (0.49) FFAR1
SCHEMBL22668074 0.84 FFAR1 (0.53) FFAR1L3MBTL1MAOBMMP12
SCHEMBL22668068 0.82 FFAR1 (0.48) FFAR1ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL22668372 0.81 FFAR1 (0.47) FFAR1ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL22668247 0.80 ALOX5 (0.46) FFAR1ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL22668399 0.79 PPARG (0.57) FFAR1ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL22668393 0.79 FFAR1 (0.56) FFAR1
SCHEMBL22668311 0.78 PLA2G4B (0.55) FFAR1ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL22668082 0.78 FFAR1 (0.51) FFAR1ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL22668067 0.75 FFAR1 (0.72) FFAR1

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