SCHEMBL9530770

SCHEMBL9530770

CC(=O)Oc1ccc2c(c1C)OC(C)(COc1ccc([N+](=O)[O-])cc1)CC2=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 2/20 0.42
RECQL P46063 1/20 0.39
KMT2A Q03164 4/20 0.37
KDM4E B2RXH2 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAOB P27338 1/20 0.36
PKM P14618 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 2/20 0.35
BCL9 O00512 1/20 0.34
CTNNB1 P35222 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34

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
SCHEMBL9530822 0.87 KDM4E (0.35) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL9534457 0.85 MAPT (0.45) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL9532944 0.84 ALDH1A1 (0.40) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL9531348 0.83 MAPT (0.49) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL8177483 0.81 KMT2A (0.39) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL9533475 0.80 ALDH1A1 (0.41) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL9531581 0.80 TLR3 (0.41) MAPTALDH1A1RECQLKMT2AKDM4E
SCHEMBL9532298 0.80 ALDH1A1 (0.45) MAPTNPC1RAB9AALDH1A1RECQL
SCHEMBL9632290 0.78 ALDH1A1 (0.44) MAPTNPC1RAB9AALDH1A1RECQL
SCHEMBL9531639 0.77 KMT2A (0.42) MAPTNPC1RAB9AALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555331-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS. SEARLE & CO (US) 1993-08-18 EP disclosed
EP-0277836-B1 THIAZOLIDINONE DERIVATIVES, THEIR PREPARATION AND THEIR USE Sankyo Company Limited (JP) 1993-06-02 EP disclosed
US-4873255-A REDUCE BLOOD GLUCOSE AND BLOOD LIPID LEVELS SANKYO COMPANY LIMITED (JP) 1989-10-10 US disclosed
EP-0277836-A1 Thiazolidinone derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-08-10 EP disclosed