SCHEMBL3946840

SCHEMBL3946840

CCOC(Cc1ccc(-c2cccc(CN(C)C(=O)c3ccc4cc(OCOCCOC)ccc4c3)c2)cc1)C(=O)N(CC)Cc1ccncc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 2/20 0.41
AOC3 Q16853 2/20 0.41
SLC2A1 P11166 7/20 0.40
HSD17B2 P37059 2/20 0.40
BAX Q07812 1/20 0.39
SLC2A4 P14672 2/20 0.39
SLC2A8 Q9NY64 1/20 0.39
ACACB O00763 1/20 0.37
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.37
PPARA Q07869 3/20 0.37
LIMK2 P53671 1/20 0.37

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
SCHEMBL3944558 0.91 AOC3 (0.41) AOC3HSD17B2BAXPPARGPPARD
SCHEMBL5569835 0.90 HSD17B2 (0.43) HSD17B2BAXPPARGPPARDPPARA
SCHEMBL5386585 0.88 PPARA (0.47) HSD17B2PPARGPPARDPPARA
SCHEMBL5399381 0.88 PPARA (0.47) HSD17B2PPARGPPARDPPARA
SCHEMBL3949115 0.84 PPARG (0.39) HSD17B2BAXPPARGPPARDPPARA
SCHEMBL3949723 0.83 HSD17B2 (0.40) AOC3HSD17B2BAXPPARGPPARD
SCHEMBL3952266 0.83 HSD17B2 (0.40) AOC3HSD17B2BAXPPARGPPARD
SCHEMBL3952268 0.82 HSD17B2 (0.39) AOC3HSD17B2BAXPPARGPPARD
SCHEMBL3955465 0.82 AOC3 (0.44) AOC3HSD17B2BAXPPARGPPARD
SCHEMBL3949725 0.81 HSD17B2 (0.38) AOC3HSD17B2BAXPPARGPPARD

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-7285568-B2 Biaromatic compounds which activate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-10-23 US claimed
US-20060004048-A1 Novel biaromatic compounds which activate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-01-05 US claimed
US-7582663-B2 Biaromatic compounds which activate PPARγ type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-09-01 US disclosed
US-20080070957-A1 Novel biaromatic compounds which activate PPARy type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2008-03-20 US disclosed
US-7285568-B2 Biaromatic compounds which activate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-10-23 US disclosed
US-20060004048-A1 Novel biaromatic compounds which activate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080070957-A1 Novel biaromatic compounds which activate PPARy type receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD ABHD6 222/4885AOC3 2202/4885SLC2A1 2478/4885
US-20060004048-A1 Novel biaromatic compounds which activate PPARgamma type receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD ABHD6 315/4885AOC3 2177/4885SLC2A1 2478/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.