SCHEMBL2903660

SCHEMBL2903660

c1nc(Oc2ccc(-c3ccc(OCC4CO4)cc3)cc2)cc(Oc2ccc(-c3ccc(OCC4CO4)cc3)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 4/20 0.49
TP53 P04637 3/20 0.49
TSHR P16473 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HIF1A Q16665 2/20 0.49
CYP3A4 P08684 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
PKM P14618 2/20 0.48
CYP1A2 P05177 2/20 0.48
PPARG P37231 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
FGFR1 P11362 1/20 0.40
SRC P12931 1/20 0.40
NPC1 O15118 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL2905365 0.95 TDP1 (0.54) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL2898835 0.85 TDP1 (0.58) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL2904530 0.85 ALDH1A1 (0.53) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL2906566 0.85 TDP1 (0.58) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL2920461 0.85 TDP1 (0.53) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL2905979 0.85 TDP1 (0.46) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL17183015 0.84 TDP1 (0.63) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL2906493 0.83 HRH3 (0.37) SMN1; SMN2CYP3A4CYP1A2NPC1CYP2C9
SCHEMBL2905896 0.82 ALDH1A1 (0.54) TDP1ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL5689043 0.82 ALDH1A1 (0.46) TDP1ALDH1A1TP53TSHRSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636209-B1 EPOXY COMPOUND AND CURED EPOXY RESIN PRODUCT SUMITOMO CHEMICAL CO (JP) 2010-08-11 EP disclosed
US-7279574-B2 Epoxy compound and cured epoxy resin product SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060159929-A1 Epoxy compound and cured epoxy resin product HITACHI, LTD. (JP) 2006-07-20 US disclosed