SCHEMBL2031635

SCHEMBL2031635

CSc1ccc(C(=O)CCc2cccc(OC(C)(C)C(=O)O)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.56
PPARA Q07869 10/20 0.56
NPC1 O15118 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
RAB9A P51151 1/20 0.46
PPARD Q03181 5/20 0.43
CYP4F2 P78329 3/20 0.43
CYP4A11 Q02928 3/20 0.43

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
SCHEMBL16472618 0.89 PPARG (0.54) PPARGPPARANPC1KDM4EALDH1A1
SCHEMBL3511380 0.84 PPARG (0.56) PPARGPPARANPC1RAB9APPARD
SCHEMBL1934701 0.81 PPARA (0.59) PPARGPPARAPPARD
SCHEMBL21016860 0.78 PPARG (0.47) PPARGPPARANPC1KDM4EALDH1A1
SCHEMBL3865193 0.77 NPC1 (0.64) NPC1ALDH1A1RAB9A
SCHEMBL3840661 0.76 PPARG (0.71) PPARGPPARAPPARDCYP4F2CYP4A11
SCHEMBL3848011 0.75 PPARA (0.69) PPARGPPARAPPARDCYP4F2CYP4A11
SCHEMBL4034371 0.75 PPARA (0.69) PPARGPPARAPPARDCYP4F2CYP4A11
SCHEMBL2437789 0.75 PPARA (0.65) PPARGPPARAPPARDCYP4F2CYP4A11
SCHEMBL2034541 0.74 PPARG (0.55) PPARGPPARAPPARDCYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136888-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2011-06-09 US claimed
US-20100286276-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2010-11-11 US claimed
EP-2046715-B1 SUBSTITUTED 1,3-DIPHENYLPROPANE DERIVATIVES, PREPARATIONS AND USES THEREOF GENFIT (FR) 2014-04-16 EP disclosed
US-8258182-B2 Substituted 1,3-diphenylpropane derivatives, preparations and uses thereof GENFIT (FR) 2012-09-04 US disclosed
US-8258182-B2 Substituted 1,3-diphenylpropane derivatives, preparations and uses thereof GENFIT (FR) 2012-09-04 US disclosed
US-8258182-B2 Substituted 1,3-diphenylpropane derivatives, preparations and uses thereof GENFIT (FR) 2012-09-04 US disclosed
US-20110136888-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2011-06-09 US disclosed
US-20110136888-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2011-06-09 US disclosed
US-20110136888-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2011-06-09 US disclosed
WO-2007147879-A1 SUBSTITUTED 1,3-DIPHENYLPROPANE DERIVATIVES, PREPARATIONS AND USES THEREOF GENFIT (FR) 2007-12-27 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-20110136888-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof DPP3, DPP4, CYP3A43 PPARG 84/4885PPARA 16/4885NPC1 250/4885
US-20100286276-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof DPP3, DPP8, DPP4 PPARG 56/4885PPARA 11/4885NPC1 90/4885

“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.