SCHEMBL7466908

SCHEMBL7466908

COC(=O)c1cc(OC)c(OC)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.68
KMT2A Q03164 3/20 0.63
CYP3A4 P08684 1/20 0.61
GAA P10253 4/20 0.59
POLB P06746 3/20 0.56
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 5/20 0.51
HSD17B10 Q99714 4/20 0.51
HTT P42858 3/20 0.51
HPGD P15428 3/20 0.51
USP2 O75604 1/20 0.51
MAPK1 P28482 1/20 0.51
MAPT P10636 1/20 0.51
GLA P06280 1/20 0.49

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
SCHEMBL6582728 0.95 KDM4E (0.67) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL7378524 0.91 KDM4E (0.73) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL6582726 0.87 LCK (0.60) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL6781993 0.85 KDM4E (0.56) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL31335674 0.85 GAA (0.54) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL19219043 0.85 KDM4E (0.55) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL8900845 0.85 GAA (0.54) KDM4EKMT2ACYP3A4GAAPOLB
SCHEMBL11317879 0.84 GAA (0.72) KDM4EKMT2AGAAPOLBMEN1
SCHEMBL8900419 0.84 GAA (0.72) KDM4EKMT2AGAAPOLBMEN1
SCHEMBL11568484 0.84 KDM4E (0.76) KDM4EKMT2ACYP3A4GAAPOLB

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-0767170-B1 NOVEL 4,6-DIARYLPYRIMIDINE DERIVATIVES AND SALTS THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2002-10-23 EP disclosed
US-6245779-B1 ANALGESICS; ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2001-06-12 US disclosed
EP-0997463-A1 NAPHTHYRIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-05-03 EP disclosed
US-5786355-A COMPOUNDS FOR TREATMENT OF CANCER, RHEUMATISM, DIABETIC RETINOPATHY OR PSORIASIS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0767170-A1 NOVEL 4,6-DIARYLPYRIMIDINE DERIVATIVES AND SALTS THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-04-09 EP disclosed