SCHEMBL3439009

SCHEMBL3439009

CCCCCCCNC(=O)N(C)c1cccc(-c2ccc(C[C@H](NCC)C(=O)N3CCC(C)CC3)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLG P00747 5/20 0.37
PRSS1 P07477 3/20 0.37
PRSS2 P07478 3/20 0.37
PRSS3 P35030 3/20 0.37
GAA P10253 1/20 0.37
F10 P00742 4/20 0.36
PLAU P00749 4/20 0.36
ST14 Q9Y5Y6 2/20 0.35
HPN P05981 1/20 0.35
ITGB3 P05106 2/20 0.35
ITGAV P06756 2/20 0.35
HPGD P15428 1/20 0.35
ADRB3 P13945 1/20 0.34
PTGS2 P35354 1/20 0.34
F2 P00734 1/20 0.34
FSHR P23945 1/20 0.33

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
SCHEMBL3439010 1.00 PLG (0.37) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL3439157 0.90 LTB4R2 (0.38) PLGPRSS1PRSS2PRSS3ST14
SCHEMBL3439137 0.89 TACR2 (0.39)
SCHEMBL3949408 0.88 PLG (0.36) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL3948253 0.87 PLG (0.36) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL3945203 0.86 PLG (0.38) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL2854526 0.85 PPARG (0.40) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL2854528 0.85 PPARG (0.40) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL3949765 0.85 PLG (0.41) PLGPRSS1PRSS2PRSS3GAA
SCHEMBL3439115 0.84 PTGS2 (0.43) PLGPRSS1PRSS2PRSS3ITGB3

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-20090062340-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARY TYPE RECEPTORS AND COSMETIC/PHARMACEUTICAL COMPOSITIONS COMPRISED THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-03-05 US claimed
US-20050256116-A1 Novel biaromatic compounds which activate PPARy type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 US claimed
US-7807669-B2 Biaromatic compounds which activate PPARγ type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-10-05 US disclosed
US-20090062340-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARY TYPE RECEPTORS AND COSMETIC/PHARMACEUTICAL COMPOSITIONS COMPRISED THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-03-05 US disclosed
US-7452878-B2 Biaromatic compounds which activate PPARγ type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-11-18 US disclosed
US-20050256116-A1 Novel biaromatic compounds which activate PPARy type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 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-20090062340-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARY TYPE RECEPTORS AND COSMETIC/PHARMACEUTICAL COMPOSITIONS COMPRISED THEREOF PPARG, PPARA, PPARD PLG 1089/4885PRSS1 3446/4885PRSS2 3911/4885
US-20050256116-A1 Novel biaromatic compounds which activate PPARy type receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD PLG 1089/4885PRSS1 3446/4885PRSS2 3911/4885

“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.