SCHEMBL28044165

SCHEMBL28044165

CCCCCc1cccc(OC(=O)CNC(=N)N)c1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 8/20 0.54
▸ PPARG P37231 5/20 0.54
▸ SPHK2 Q9NRA0 1/20 0.46
▸ SPHK1 Q9NYA1 1/20 0.46
▸ TRPV1 Q8NER1 1/20 0.46

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
SCHEMBL28044220 0.82 CYP4F2 (0.39) PPARAPPARGTRPV1
SCHEMBL28337010 0.81 PPARA (0.62) PPARAPPARG
SCHEMBL3404983 0.80 PPARA (0.61) PPARAPPARG
SCHEMBL29328712 0.79 PPARA (0.64) PPARAPPARG
SCHEMBL646706 0.79 PPARA (0.64) PPARAPPARG
SCHEMBL27678746 0.79 PLAU (0.46) —
SCHEMBL29328704 0.78 PPARA (0.63) PPARAPPARG
SCHEMBL29328706 0.78 PPARA (0.63) PPARAPPARG
SCHEMBL29328702 0.78 PPARA (0.63) PPARAPPARG
SCHEMBL28392302 0.78 PPARA (0.63) PPARAPPARG

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
CN-105143170-A Substituted aromatic compounds for the treatment of pulmonary fibrosis, liver fibrosis, skin fibrosis and cardiac fibrosis PROMETIC BIOSCIENCES INC 2015-12-09 — — CN disclosed
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