SCHEMBL22668477

SCHEMBL22668477

CCCc1ccc(OCc2ccc(OC/C(=N\OC)c3ccc(OC)cc3)cc2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.46
PLA2G4B P0C869 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
APP P05067 5/20 0.39
KMT2A Q03164 2/20 0.38
HSP90AA1 P07900 1/20 0.38
MEN1 O00255 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL22668386 0.90 RAB9A (0.46) FFAR1NPC1RAB9ASENP8SENP7
SCHEMBL15248870 0.89 FFAR1 (0.46) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL22668329 0.88 FFAR1 (0.46) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL435299 0.88 FFAR1 (0.55) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL435298 0.88 FFAR1 (0.55) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL15239614 0.86 FFAR1 (0.48) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL15239615 0.86 FFAR1 (0.48) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL22668438 0.86 PLA2G4B (0.46) FFAR1PLA2G4BNPC1RAB9APOLB
SCHEMBL22668237 0.82 FFAR1 (0.49) FFAR1
SCHEMBL22668392 0.81 RAB9A (0.45) FFAR1PLA2G4BNPC1RAB9APOLB

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