SCHEMBL2904558

SCHEMBL2904558

Cc1cc(Oc2ccc(-c3ccc(OCCCCC4CO4)cc3)cc2)nc(Oc2ccc(-c3ccc(OCCCCC4CO4)cc3)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
CYP2C9 P11712 5/20 0.39
CYP2C19 P33261 5/20 0.39
CYP1A2 P05177 4/20 0.39
HTT P42858 2/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NOS2 P35228 1/20 0.38
CYP19A1 P11511 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL2898624 0.87 FFAR4 (0.37) ALDH1A1CYP2C9CYP2C19CYP1A2HTT
SCHEMBL2898805 0.86 ALDH1A1 (0.45) ALDH1A1GAASMN1; SMN2LMNACYP2C9
SCHEMBL5632761 0.84 NOS2 (0.36) GAACYP2C9CYP2C19CYP1A2NOS2
SCHEMBL5687175 0.82 NPSR1 (0.44) ALDH1A1GAASMN1; SMN2CYP2C9CYP2C19
SCHEMBL2904893 0.82 ALDH1A1 (0.48) ALDH1A1GAASMN1; SMN2LMNACYP1A2
SCHEMBL2905143 0.81 HDAC3 (0.39) MEN1KMT2A
SCHEMBL2898836 0.81 HRH3 (0.34) ALDH1A1GAALMNACYP2C9CYP2C19
SCHEMBL2906493 0.81 HRH3 (0.37) SMN1; SMN2CYP2C9CYP2C19CYP1A2NPC1
SCHEMBL2903528 0.80 MEN1 (0.37) ALDH1A1LMNACYP2C9CYP2C19CYP1A2
SCHEMBL2899269 0.80 LTA4H (0.36) CYP2C9CYP2C19CYP19A1CYP2D6

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-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
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