SCHEMBL7631124

SCHEMBL7631124

C=CC(=O)OC(COc1ccc(C(C)(C)c2ccc(OCC(OCC)(OCC)OC(=O)C=C)cc2)cc1)(OCC)OCC

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.40
ALDH1A1 P00352 6/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
GAA P10253 2/20 0.40
POLB P06746 2/20 0.37
THRB P10828 2/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
HTT P42858 2/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL9820439 0.85 THRB (0.49) KDM4EALDH1A1SMN1; SMN2GAATHRB
SCHEMBL7622862 0.82 KDM4E (0.37) KDM4EALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL7625531 0.79 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL19255443 0.75 THRB (0.32) KDM4EALDH1A1SMN1; SMN2GAATHRB
SCHEMBL8557158 0.75 PLK1 (0.44) SMN1; SMN2POLBTHRBMEN1KMT2A
SCHEMBL26048815 0.75 THRB (0.53) KDM4EALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL31451650 0.75 ALDH1A1 (0.43) KDM4EALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL21779001 0.74 THRB (0.58) KDM4EALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL93929 0.74 THRB (0.46) KDM4EALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL8731568 0.73 THRB (0.40) ALDH1A1SMN1; SMN2THRBTP53HPGD

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-5942303-A CURABLE ADDITION TERPOLYMER BASED ON 2,2-BIS(P-(METH)ACRYLOYL -(P-(METH)ACRYLOYLOXY(ALKYLOXY)N-PHENYL)PROPANES, WHERE N IS 2-5, AND UNSATURATED COMPOUND; IMPACT STRENGTH; LOW SPECIFIC GRAVITY; LIGHTWEIGHT; EYEGLASSES; CONTACT LENSES; LENSES NOF CORPORATION (JP) 1999-08-24 US claimed
EP-0828167-B1 Resin composition for polymerization casting and optical material NOF CORP (JP) 2002-07-03 EP disclosed
US-5942303-A CURABLE ADDITION TERPOLYMER BASED ON 2,2-BIS(P-(METH)ACRYLOYL -(P-(METH)ACRYLOYLOXY(ALKYLOXY)N-PHENYL)PROPANES, WHERE N IS 2-5, AND UNSATURATED COMPOUND; IMPACT STRENGTH; LOW SPECIFIC GRAVITY; LIGHTWEIGHT; EYEGLASSES; CONTACT LENSES; LENSES NOF CORPORATION (JP) 1999-08-24 US disclosed
EP-0828167-A2 Resin composition for polymerization casting and optical material NOF CORPORATION (JP) 1998-03-11 EP disclosed