SCHEMBL9515570

SCHEMBL9515570

COC(=O)c1cc2c3c(OC)c1-c1c(C(=O)OC)cc(c(c1OC)OCO3)OCO2

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 5/20 0.73
GSK3B P49841 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ATR Q13535 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 3/20 0.44
HTT P42858 2/20 0.43
RECQL P46063 2/20 0.43
OPRK1 P41145 1/20 0.43
DYRK1A Q13627 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CDK2 P24941 1/20 0.40

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
SCHEMBL9514705 0.92 TARBP2 (0.64) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL9511802 0.91 TARBP2 (0.63) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL17714984 0.88 TARBP2 (0.77) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL17714981 0.87 TARBP2 (0.60) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL5242268 0.85 TARBP2 (0.59) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL17714992 0.85 TARBP2 (0.59) TARBP2GSK3BMEN1KMT2AKDM4E
SCHEMBL9514640 0.85 TARBP2 (0.59) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL9512524 0.85 TARBP2 (0.56) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL17714982 0.84 TARBP2 (0.74) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL17714978 0.81 TARBP2 (0.77) TARBP2MEN1KMT2AKDM4EALDH1A1

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-0269754-B1 NOVEL BIPHENYL DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE TSUMURA & CO (JP) 1993-11-03 EP disclosed
US-4987240-A PREFERENTIAL DEHALOGENATION OF CHEMICAL INTERMEDIATE TSUMURA & CO. (JP) 1991-01-22 US disclosed
US-4962211-A MODERATING ACTION ON LIVER DISORDERS; CHEMICAL INTERMEDIATES; ACUTE AND CHRONIC HEPATITIS TSUMURA & CO. (JP) 1990-10-09 US disclosed
US-4904694-A HEPATITIS TSUMURA & CO. (JP) 1990-02-27 US disclosed
EP-0269754-A1 NOVEL BIPHENYL DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE TSUMURA & CO. (JP) 1988-06-08 EP disclosed