SCHEMBL7940707

SCHEMBL7940707

NC(=O)Oc1c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c2c1=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.72
POLH Q9Y253 8/20 0.72
KDM4E B2RXH2 5/20 0.72
POLB P06746 5/20 0.72
MEN1 O00255 4/20 0.72
KMT2A Q03164 4/20 0.72
GAA P10253 4/20 0.72
RECQL P46063 4/20 0.72
HSD17B10 Q99714 3/20 0.72
MAPT P10636 3/20 0.72
APEX1 P27695 3/20 0.72
MMP1 P03956 2/20 0.72
BLM P54132 2/20 0.72
HTT P42858 1/20 0.72
SRC P12931 5/20 0.65
CYP3A4 P08684 3/20 0.65
USP2 O75604 2/20 0.65
TP53 P04637 2/20 0.65
CYP1A2 P05177 2/20 0.65
CYP2C9 P11712 2/20 0.65

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
SCHEMBL31236662 0.88 POLH (0.76) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL4175201 0.88 POLH (0.76) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL14786208 0.86 POLH (0.81) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL23442030 0.86 EPHX2 (0.88) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL23442126 0.86 EPHX2 (0.88) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL28040773 0.85 EPHX2 (0.69) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL23441996 0.85 EPHX2 (0.82) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL4170634 0.85 POLH (0.74) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL15928808 0.85 POLH (0.71) EPHX2POLHKDM4EPOLBMEN1
SCHEMBL28297226 0.85 POLH (0.79) EPHX2POLHKDM4EPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6258840-B1 ANTITUMOR AGENTS, ANTIINFLAMMATORY AGENTS, ENZYME INHIBITORS OF KINASES COBRA THERAPEUTICS LIMITED (GB) 2001-07-10 US claimed
US-6258840-B1 ANTITUMOR AGENTS, ANTIINFLAMMATORY AGENTS, ENZYME INHIBITORS OF KINASES COBRA THERAPEUTICS LIMITED (GB) 2001-07-10 US disclosed
EP-0912541-A1 ANALOGUES OR DERIVATIVES OF QUERCETIN (PRODRUGS) Cobra Therapeutics Limited (GB) 1999-05-06 EP disclosed
WO-1997049693-A1 ANALOGUES OR DERIVATIVES OF QUERCETIN (PRODRUGS) COBRA THERAPEUTICS LIMITED (GB) 1997-12-31 WO disclosed