SCHEMBL3210607

SCHEMBL3210607

CCCCCCCNC(=O)N(C)c1cccc(-c2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.49
ALOX15 P16050 3/20 0.48
EPHX1 P07099 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PTGS2 P35354 1/20 0.46
EGFR P00533 1/20 0.44

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
SCHEMBL3200012 0.88 NAAA (0.52) NAAAEPHX1ALDH1A1HTTNPC1
SCHEMBL2085132 0.88 HPGD (0.46) PTGS2
SCHEMBL2083239 0.88 HPGD (0.46) PTGS2
SCHEMBL2083468 0.88 HPGD (0.46) PTGS2
SCHEMBL4137357 0.88 NAAA (0.58) NAAAEPHX1ALDH1A1HTTNPC1
SCHEMBL4228293 0.87 EGFR (0.49) ALOX15ALDH1A1NPC1RAB9APTGS2
SCHEMBL2083408 0.87 EGFR (0.49) ALOX15ALDH1A1NPC1RAB9APTGS2
SCHEMBL2083411 0.87 EGFR (0.49) ALOX15ALDH1A1NPC1RAB9APTGS2
SCHEMBL5364431 0.87 LTB4R2 (0.45) NAAAALOX15PTGS2
SCHEMBL2083094 0.86 HPGD (0.47)

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 3 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

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 1943/4885ALOX15 143/4885EPHX1 1121/4885
US-20100035988-A1 Methods for activating PPAR gamma-type receptors PPARG, PPARA, PPARD NAAA 1781/4885ALOX15 189/4885EPHX1 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.