SCHEMBL8930803

SCHEMBL8930803

COc1cc(C)ccc1NC(=O)C(C)C(C)=O

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 11/20 0.66
EPHX1 P07099 2/20 0.58
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
POLB P06746 2/20 0.51
MAPT P10636 2/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPK1 P28482 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
NPC1 O15118 1/20 0.48
AHR P35869 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL8930728 0.81 MEN1 (0.57) MEN1KMT2APOLBMAPTLMNA
SCHEMBL3831243 0.81 EPHX1 (0.72) LPAR1EPHX1MEN1KMT2APOLB
SCHEMBL30388763 0.81 EPHX1 (0.72) LPAR1EPHX1MEN1KMT2APOLB
SCHEMBL8930775 0.80 POLB (0.58) LPAR1MEN1KMT2APOLBMAPT
SCHEMBL8930615 0.79 SMN1; SMN2 (0.57) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5923961 0.78 LPAR1 (0.62) LPAR1EPHX1MEN1KMT2APOLB
SCHEMBL12339799 0.77 GAA (0.58) MEN1KMT2APOLBMAPTSMN1; SMN2
SCHEMBL28817103 0.77 RAB9A (0.56) LPAR1MEN1KMT2APOLBSMN1; SMN2
SCHEMBL29639811 0.76 EPHX1 (0.61) LPAR1EPHX1MEN1KMT2APOLB
SCHEMBL10506942 0.76 EPHX1 (0.61) LPAR1EPHX1MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188203-B2 Intraocular lens formed from a polymer of an unsaturated aryl monoazo dye containing a 2-pyrazolin-5-one, dimedone (5,5-dimethyl-1,3-cyclohexanedione), acetoacetamide, malonamide, barbituric acid or 1,3-propanedione residue; yellow light absorbers; block ultraviolet and/or violet-blue light transmission Abbott Medical Optics Inc. (US) 2012-05-29 US disclosed
US-8188203-B2 Intraocular lens formed from a polymer of an unsaturated aryl monoazo dye containing a 2-pyrazolin-5-one, dimedone (5,5-dimethyl-1,3-cyclohexanedione), acetoacetamide, malonamide, barbituric acid or 1,3-propanedione residue; yellow light absorbers; block ultraviolet and/or violet-blue light transmission Abbott Medical Optics Inc. (US) 2012-05-29 US disclosed
US-20080182957-A1 Copolymerizable azo compounds and articles containing them Johnson & Johnson Surgical Vision, Inc. 2008-07-31 US disclosed
US-20080182957-A1 Copolymerizable azo compounds and articles containing them Johnson & Johnson Surgical Vision, Inc. 2008-07-31 US disclosed
US-7326423-B2 Copolymerizable azo compounds and articles containing them ADVANCED MEDICAL OPTICS, INC. (US) 2008-02-05 US disclosed
US-7326423-B2 Copolymerizable azo compounds and articles containing them ADVANCED MEDICAL OPTICS, INC. (US) 2008-02-05 US disclosed