SCHEMBL7625525

SCHEMBL7625525

C=CC(=O)OC(CC)OC(CC)OC(CC)Oc1ccc(C(C)(C)c2ccc(OC(CC)OC(CC)OC(CC)OC(=O)C=C)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.36
KDM4E B2RXH2 7/20 0.35
ALDH1A1 P00352 7/20 0.35
HTT P42858 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KMT2A Q03164 3/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 2/20 0.35
AR P10275 2/20 0.33
NR1H4 Q96RI1 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
POLB P06746 2/20 0.32
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL959624 0.92 ALDH1A1 (0.40) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL9517525 0.85 ALDH1A1 (0.36) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL7623767 0.84 AR (0.36) KDM4EALDH1A1HTTSMN1; SMN2KMT2A
SCHEMBL14182067 0.78 THRB (0.43) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL14113638 0.78 MAPT (0.43) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL137573 0.77 ALDH1A1 (0.37) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL5899611 0.76 KMT2A (0.41) KDM4EALDH1A1HTTSMN1; SMN2KMT2A
SCHEMBL6905540 0.76 ALDH1A1 (0.35) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL28244460 0.76 THRB (0.48) THRBKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL2921941 0.76 TSHR (0.42) THRBALDH1A1SMN1; SMN2HIF1A

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