SCHEMBL2087162

SCHEMBL2087162

CCCCCCCNC(=S)N(C)c1cccc(-c2ccc(CCC(=O)OCC)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
HPGD P15428 1/20 0.40
MMEL1 Q495T6 1/20 0.40
CYP4Z1 Q86W10 1/20 0.39
PTGS2 P35354 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
NAMPT P43490 2/20 0.38
EPHX2 P34913 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 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
SCHEMBL2085623 0.91 CYP4F2 (0.41) CYP4F2CYP4A11HPGDMMEL1CYP4Z1
SCHEMBL2086788 0.91 CYP4F2 (0.41) CYP4F2CYP4A11HPGDMMEL1CYP4Z1
SCHEMBL2083156 0.88 HPGD (0.46) HPGDPTGS2LTB4R2
SCHEMBL2086756 0.88 HPGD (0.46) HPGDPTGS2LTB4R2
SCHEMBL2083862 0.83 HPGD (0.42) HPGDPTGS2LTB4R2
SCHEMBL2085836 0.82 HPGD (0.43) HPGDPTGS2LTB4R2
SCHEMBL2084566 0.82 NAMPT (0.44) CYP4F2CYP4A11MMEL1NAMPT
SCHEMBL2083875 0.80 SENP1 (0.42) CYP4F2CYP4A11HPGDMMEL1CYP4Z1
SCHEMBL68850 0.79 RAB9A (0.38) HPGDEPHX2PPARGPPARA
SCHEMBL2085088 0.79 PTGS2 (0.49) PTGS2PPARGPPARA

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-7863332-B2 Biaromatic compound activators of PPARγ receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-01-04 US disclosed
EP-1781297-B1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2008-10-15 EP disclosed
US-20070213336-A1 Biaromatic compound activators of ppargamma receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-13 US disclosed
EP-1781297-A1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-05-09 EP disclosed
WO-2006018326-A1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-02-23 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 (1 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-20070213336-A1 Biaromatic compound activators of ppargamma receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD CYP4F2 601/4885CYP4A11 258/4885HPGD 514/4885

“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.