SCHEMBL3200016

SCHEMBL3200016

CCCCCCCNC(=O)N(C)c1ccccc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.50
ASAH1 Q13510 2/20 0.48
EPHX1 P07099 3/20 0.48
ALDH1A1 P00352 1/20 0.48
HTT P42858 1/20 0.48
SOAT1 P35610 2/20 0.47
LTB4R2 Q9NPC1 1/20 0.46
NAMPT P43490 2/20 0.45
EGFR P00533 1/20 0.45

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
SCHEMBL5268847 0.99 NAAA (0.48) NAAAASAH1EPHX1ALDH1A1HTT
SCHEMBL4133486 0.81 NAAA (0.49) NAAAASAH1EPHX1ALDH1A1HTT
SCHEMBL3200012 0.81 NAAA (0.52) NAAAEPHX1ALDH1A1HTTEGFR
SCHEMBL9508710 0.81 ALDH1A1 (0.50) NAAAEPHX1ALDH1A1HTTNAMPT
SCHEMBL4137357 0.80 NAAA (0.58) NAAAASAH1EPHX1ALDH1A1HTT
SCHEMBL3210607 0.78 NAAA (0.49) NAAAEPHX1ALDH1A1HTTEGFR
SCHEMBL4137692 0.78 EPHX2 (0.52) NAAAEPHX1ALDH1A1HTTNAMPT
SCHEMBL4611224 0.77 EGFR (0.47) NAAAALDH1A1LTB4R2EGFR
SCHEMBL9100859 0.75 NAAA (0.55) NAAAASAH1EPHX1ALDH1A1HTT
SCHEMBL13772465 0.75 HSD17B10 (0.47) NAAAEPHX1ALDH1A1HTTSOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-1742608-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϝ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-01-17 EP disclosed
WO-2005108352-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϜ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 WO 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 NAAA 1943/4885ASAH1 497/4885EPHX1 1121/4885
US-20100035988-A1 Methods for activating PPAR gamma-type receptors PPARG, PPARA, PPARD NAAA 1781/4885ASAH1 620/4885EPHX1 1414/4885

“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.