SCHEMBL22668359

SCHEMBL22668359

CO/N=C(\COc1ccc(COc2ccc(/C=C/C(O)O)c(OC)c2)cc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.52
PTPN1 P18031 2/20 0.42
MAPT P10636 3/20 0.40
APP P05067 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAOB P27338 3/20 0.39
POLB P06746 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL22668030 0.88 FFAR1 (0.55) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL22668269 0.87 PTPN1 (0.43) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL15239318 0.87 FFAR1 (0.56) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL10258506 0.87 FFAR1 (0.56) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL15239336 0.87 FFAR1 (0.56) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL15239317 0.87 FFAR1 (0.56) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL435344 0.86 FFAR1 (0.57) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL435343 0.86 FFAR1 (0.57) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL10260721 0.83 FFAR1 (0.52) FFAR1PTPN1MAPTAPPHDAC8
SCHEMBL22668270 0.79 PTPN1 (0.41) FFAR1PTPN1MAPTAPPHDAC8

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