SCHEMBL14567309

SCHEMBL14567309

C=N/N=C(\NN)[C@@H](CC(=O)O)c1ccc(OCc2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.42
▸ FFAR1 O14842 14/20 0.41
▸ CYP26A1 O43174 2/20 0.41
▸ CYP26B1 Q9NR63 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41

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
SCHEMBL13350368 0.85 PPARG (0.42) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL13350393 0.80 FFAR1 (0.39) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL3553563 0.80 PPARG (0.47) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL3553559 0.80 PPARG (0.47) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL3555152 0.80 PPARG (0.47) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL13350413 0.80 PPARG (0.41) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL13350369 0.79 FFAR1 (0.41) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL13350351 0.79 FFAR1 (0.41) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL13350350 0.78 FFAR1 (0.41) PPARGFFAR1CYP26A1CYP26B1CYP3A4
SCHEMBL13350450 0.77 FFAR1 (0.41) PPARGFFAR1CYP26A1CYP26B1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007033002-A1 CONFORMATIONALLY CONSTRAINED 3- (4-HYDROXY-PHENYL) - SUBSTITUTED-PROPANOIC ACIDS USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2007-03-22 — — WO disclosed
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