SCHEMBL5317075

SCHEMBL5317075

Oc1ccc(Oc2cnccn2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.62
KMT2A Q03164 3/20 0.58
LTA4H P09960 4/20 0.51
PTGS2 P35354 1/20 0.51
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 1/20 0.48
MAPK1 P28482 1/20 0.45
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
PLAAT3 P53816 1/20 0.42
PLAAT5 Q96KN8 1/20 0.42
PLAAT2 Q9NWW9 1/20 0.42
PLAAT4 Q9UL19 1/20 0.42
NR1H2 P55055 1/20 0.42
BAX Q07812 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL5687538 0.84 KDM4E (0.50) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL29415425 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL15955267 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL29580801 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL171894 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL789285 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL4799638 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL4799634 0.81 KDM4E (0.62) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL4272944 0.80 KDM4E (0.61) KDM4EKMT2ALTA4HPTGS2MEN1
SCHEMBL18355733 0.79 KMT2A (0.68) KDM4EKMT2ALTA4HPTGS2SMN1; SMN2

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
CN-1835946-B Epoxy compound and cured epoxy resin product SUMITOMO CHEMICAL CO 2010-06-16 CN disclosed
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed
CN-1835946-A Epoxy compound and cured epoxy resin product SUMITOMO CHEMICAL CO (JP) 2006-09-20 CN disclosed
EP-1636209-A1 EPOXY COMPOUND AND CURED EPOXY RESIN PRODUCT Sumitomo Chemical Company, Limited (JP) 2006-03-22 EP disclosed
WO-2004113327-A1 EPOXY COMPOUND AND CURED EPOXY RESIN PRODUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-12-29 WO disclosed