SCHEMBL9514705

SCHEMBL9514705

COC(=O)c1cc(OC)c(OC)c(OC)c1-c1c(C(=O)OC)cc2c(c1OC)OCO2

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 5/20 0.64
GSK3B P49841 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
ATR Q13535 1/20 0.54
HTT P42858 2/20 0.52
RECQL P46063 2/20 0.52
OPRK1 P41145 1/20 0.52
POLB P06746 6/20 0.49
KDM4E B2RXH2 2/20 0.49
USP2 O75604 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP3A4 P08684 1/20 0.44

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
SCHEMBL9515570 0.92 TARBP2 (0.73) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL9513890 0.88 GSK3B (0.55) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL9330285 0.87 POLB (0.51) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL9511802 0.84 TARBP2 (0.63) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL11929030 0.82 KDM4E (0.69) KMT2AHTTPOLBKDM4EUSP2
SCHEMBL17714984 0.81 TARBP2 (0.77) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL17714981 0.80 TARBP2 (0.60) TARBP2GSK3BMEN1KMT2AATR
SCHEMBL12145714 0.79 KDM4E (0.54) TARBP2POLBKDM4EUSP2HSD17B10
SCHEMBL17714992 0.79 TARBP2 (0.59) TARBP2GSK3BMEN1KMT2AHTT
SCHEMBL9514640 0.79 TARBP2 (0.59) TARBP2GSK3BMEN1KMT2AATR

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 6 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-5032685-A Hepatitis TSUMURA JUNTENDO, INC. (JP) 1991-07-16 US 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