SCHEMBL7623770

SCHEMBL7623770

C=C(C)C(=O)OC(CCOc1ccc(C(C)(C)c2ccc(OCCC(OCCC)(OCCC)OC(=O)C(=C)C)cc2)cc1)(OCCC)OCCC

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.43
POLB P06746 3/20 0.43
ALDH1A1 P00352 8/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
HTT P42858 3/20 0.42
ACACB O00763 2/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 1/20 0.39
APEX1 P27695 1/20 0.38

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
SCHEMBL7625531 0.83 KDM4E (0.46) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL7622862 0.79 KDM4E (0.37) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL28498647 0.78 ACACB (0.50) KDM4EPOLBALDH1A1HTTACACB
SCHEMBL10375214 0.77 HTT (0.39) KDM4EPOLBALDH1A1MEN1KMT2A
Propane SCHEMBL9476274 0.76 HTT (0.53) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL14173142 0.75 POLB (0.56) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL59813 0.75 POLB (0.56) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL19327020 0.75 ABCB11 (0.33) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL346370 0.74 POLB (0.62) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL7631159 0.74 ACACB (0.41) KDM4EPOLBALDH1A1MEN1KMT2A

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