SCHEMBL6972762

SCHEMBL6972762

C=C(O)Cc1cc(OC)c(OCc2ccccc2)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
GAA P10253 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
BLM P54132 1/20 0.50
MAOB P27338 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46

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
SCHEMBL7511997 0.84 HSD17B10 (0.58) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL3456646 0.84 HPGD (0.52) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL9182397 0.84 ALDH1A1 (0.47) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL8862695 0.82 HTR1A (0.49) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL3457611 0.81 CYP4F2 (0.54) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL12431888 0.80 HTR1A (0.50) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL27998563 0.80 MAOB (0.59) MEN1KMT2AALDH1A1GAAMAOB
SCHEMBL10925538 0.80 HTR1A (0.50) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL19490990 0.80 ALDH1A1 (0.53) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL22555976 0.80 HPGD (0.53) MEN1KMT2AKDM4ESMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783496-B9 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-03 EP disclosed
EP-0783496-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 EP disclosed
US-5965589-A AN ACTIVE MATERIAL HAVING HYPOGLYCEMIC ACTIVITY AND BLOOD LIPID LOWERING ACTIVITY, FOR USE AS AN ANTIDIABETIC AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-12 US disclosed
EP-0783496-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-07-16 EP disclosed
WO-1996005186-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-22 WO disclosed