SCHEMBL9048733

SCHEMBL9048733

COc1cccc(OC)c1C=C1CC(=O)OC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP19A1 P11511 2/20 0.38
MAOB P27338 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
AMY1A P0DUB6 1/20 0.37
MIF P14174 1/20 0.37
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NFE2L2 Q16236 1/20 0.36

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
SCHEMBL9048726 1.00 CA12 (0.41) CA12CA9KDM4EALDH1A1MAPT
SCHEMBL9050261 0.83 KDM4E (0.57) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL9050279 0.83 KDM4E (0.57) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL9046794 0.78 KDM4E (0.34) KDM4EALDH1A1MAPTCYP1A2CYP3A4
SCHEMBL10335357 0.77 MAPT (0.61) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL9123520 0.77 MAPT (0.61) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL17899552 0.75 MAPT (0.56) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL9740375 0.75 ATM (0.61) KDM4EALDH1A1MAPTMAOBMIF
SCHEMBL9740370 0.75 ATM (0.61) KDM4EALDH1A1MAPTMAOBMIF
SCHEMBL9047779 0.75 MEN1 (0.41) ALDH1A1MAOBCYP1A2CYP3A4CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed