SCHEMBL2174731

SCHEMBL2174731

CCCCCCCNC(=O)N(C)c1cccc(-c2ccc(CC(OC)C(=O)O)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.47
PPARA Q07869 6/20 0.47
PPARD Q03181 2/20 0.47
PTGS2 P35354 1/20 0.45
SRR Q9GZT4 2/20 0.41
PSAT1 Q9Y617 2/20 0.41
ITGB3 P05106 2/20 0.39
ITGAV P06756 2/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
PLG P00747 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC6 Q9UBN7 2/20 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
SCHEMBL2174738 1.00 PPARG (0.47) PPARGPPARAPPARDPTGS2SRR
SCHEMBL2173704 0.99 PPARG (0.48) PPARGPPARAPPARDPTGS2SRR
SCHEMBL2173699 0.99 PPARG (0.48) PPARGPPARAPPARDPTGS2SRR
SCHEMBL2173206 0.92 PPARA (0.45) PPARGPPARAPPARDPTGS2ITGB3
SCHEMBL2173202 0.92 PPARA (0.45) PPARGPPARAPPARDPTGS2ITGB3
SCHEMBL2174476 0.92 PPARA (0.45) PPARGPPARAPPARDPTGS2ITGB3
SCHEMBL3946797 0.91 PTGS2 (0.44) PPARGPPARAPPARDPTGS2PLG
SCHEMBL2173074 0.91 PTGS2 (0.44) PPARGPPARAPPARDPTGS2SRR
SCHEMBL2173079 0.91 PTGS2 (0.44) PPARGPPARAPPARDPTGS2SRR
SCHEMBL2172731 0.91 PPARA (0.46) PPARGPPARAPPARDPTGS2LTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973063-B2 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-07-05 US claimed
EP-1742608-B1 BIAROMATIC COMPOUNDS WHICH ACTIVATE PPAR(GAMMA) TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2010-02-24 EP claimed
US-20100035988-A1 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-02-11 US claimed
US-7626054-B2 Biaromatic compounds which activate PPARγ-type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-12-01 US claimed
US-20070112070-A1 Novel biaromatic compounds which activate PPARy-type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-05-17 US claimed
US-7973063-B2 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-07-05 US disclosed
US-20100035988-A1 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-02-11 US disclosed
US-7626054-B2 Biaromatic compounds which activate PPARγ-type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-12-01 US disclosed
US-20070112070-A1 Novel biaromatic compounds which activate PPARy-type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-05-17 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-20070112070-A1 Novel biaromatic compounds which activate PPARy-type receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885
US-20100035988-A1 Methods for activating PPAR gamma-type receptors PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885PPARD 3/4885

“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.