SCHEMBL9531348

SCHEMBL9531348

Cc1c(OCc2ccccc2)ccc2c1OC(C)(COc1ccc([N+](=O)[O-])cc1)CC2=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
ALDH1A1 P00352 1/20 0.49
MAOB P27338 5/20 0.44
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
CYP19A1 P11511 6/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
SIRT1 Q96EB6 1/20 0.37

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
SCHEMBL9530770 0.83 MAPT (0.42) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL9534457 0.82 MAPT (0.45) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL11445859 0.80 MRGPRX4 (0.46) MAPTMAOBSMN1; SMN2MRGPRX4
SCHEMBL9531990 0.76 ALDH1A1 (0.52) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL9531639 0.75 KMT2A (0.42) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL9533475 0.73 ALDH1A1 (0.41) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL8980424 0.72 KMT2A (0.44) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL9530822 0.71 KDM4E (0.35) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL9533182 0.69 ALDH1A1 (0.47) MAPTNPC1RAB9AALDH1A1MAOB
SCHEMBL9530858 0.69 ALDH1A1 (0.48) MAPTNPC1RAB9AALDH1A1MAOB

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-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