SCHEMBL4136190

SCHEMBL4136190

C=COc1ccc(Cc2ccc(OC=C)c(OCC)c2OCC)c(OCC)c1OCC

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TUBB1 Q9H4B7 2/20 0.31
NQO1 P15559 1/20 0.30
GABRA1 P14867 2/20 0.30
GABRB2 P47870 2/20 0.30

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
SCHEMBL9416185 0.85 NQO1 (0.34) KDM4EALDH1A1TUBB1NQO1GABRA1
SCHEMBL31195638 0.81 KDM4E (0.42) KDM4EALDH1A1TUBB1NQO1
SCHEMBL9619092 0.78 ALDH1A1 (0.36) KDM4EALDH1A1TUBB1NQO1GABRA1
SCHEMBL22472259 0.78 MAPT (0.42) KDM4EALDH1A1TUBB1
SCHEMBL4123478 0.77 MEN1 (0.30) ALDH1A1
SCHEMBL30029361 0.76 THRB (0.44) KDM4EALDH1A1
SCHEMBL331318 0.76 THRB (0.44) KDM4EALDH1A1
SCHEMBL2243359 0.73 ALDH1A1 (0.42) KDM4EALDH1A1
SCHEMBL330418 0.71 HSD17B10 (0.35) KDM4EALDH1A1
SCHEMBL29489300 0.71 HSD17B10 (0.35) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090068569-A1 Resin composition for hologram recording material, hologram recording material, and method for producing hologram recording medium NIPPON PAINT CO., LTD. 2009-03-12 US disclosed