SCHEMBL3510221

SCHEMBL3510221

CC(C)(Sc1ccc(CCC(=O)c2ccc(Cl)cc2O)cc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.45
PPARG P37231 6/20 0.45
TBXAS1 P24557 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALOX15 P16050 2/20 0.40
CYP19A1 P11511 1/20 0.39
PPARD Q03181 3/20 0.38
MAPK1 P28482 1/20 0.37
KLKB1 P03952 1/20 0.37
TBXA2R P21731 1/20 0.36

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
SCHEMBL644294 0.78 ALOX15 (0.56) MEN1KMT2AALOX15CYP19A1MAPK1
SCHEMBL3513490 0.75 PPARA (0.41) PPARAPPARGTBXAS1MEN1KMT2A
SCHEMBL814723 0.74 MAOB (0.56) MEN1KMT2AALOX15CYP19A1MAPK1
SCHEMBL25218067 0.74 MAOB (0.56) MEN1KMT2AALOX15CYP19A1MAPK1
SCHEMBL27874951 0.74 MEN1 (0.34) MEN1KMT2AALOX15CYP19A1MAPK1
SCHEMBL4398676 0.73 PPARA (0.51) PPARAPPARGTBXAS1MEN1KMT2A
SCHEMBL4192083 0.71 PPARA (0.59) PPARAPPARGTBXAS1KMT2APPARD
SCHEMBL27874950 0.70 HTT (0.34) MEN1KMT2AALOX15MAPK1KLKB1
SCHEMBL5333496 0.70 TBXAS1 (0.51) PPARAPPARGTBXAS1KMT2AALOX15
SCHEMBL11539611 0.69 SLC22A12 (0.48) PPARAPPARGTBXAS1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046716-B1 SUBSTITUTED 1,3-DIPHENYLPROPANE DERIVATIVES, PREPARATIONS AND USES THEREOF GENFIT (FR) 2013-08-14 EP disclosed
US-8188148-B2 Substituted 1,3-diphenylpropane derivatives, preparations and uses thereof GENFIT (FR) 2012-05-29 US disclosed
US-8188148-B2 Substituted 1,3-diphenylpropane derivatives, preparations and uses thereof GENFIT (FR) 2012-05-29 US disclosed
US-8188148-B2 Substituted 1,3-diphenylpropane derivatives, preparations and uses thereof GENFIT (FR) 2012-05-29 US disclosed
US-20100286276-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2010-11-11 US disclosed
US-20100286276-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2010-11-11 US disclosed
US-20100286276-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof GENFIT (FR) 2010-11-11 US disclosed
WO-2007147880-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 (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-20100286276-A1 Substituted 1,3-Diphenylpropane Derivatives, Preparations and Uses Thereof DPP3, DPP8, DPP4 PPARA 11/4885PPARG 56/4885TBXAS1 998/4885

“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.