SCHEMBL15519366

SCHEMBL15519366

Cc1cc(Cc2cc3nc(C(F)(F)F)ccc3n2S(=O)(=O)c2cccc(C(C)(C)C)c2)ccc1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PPARG P37231 7/20 0.36
▸ PPARA Q07869 6/20 0.36
▸ PPARD Q03181 5/20 0.36
▸ NR1H4 Q96RI1 1/20 0.36
▸ RORC P51449 4/20 0.35
▸ HTR6 P50406 2/20 0.33
▸ AGTR1 P30556 1/20 0.33
▸ AGTR2 P50052 1/20 0.33
▸ TRPM8 Q7Z2W7 1/20 0.33
▸ CPT2 P23786 1/20 0.33
▸ CPT1A P50416 1/20 0.33
▸ CPT1B Q92523 1/20 0.33

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
SCHEMBL14053489 0.90 TP53 (0.39) TP53MAPTPPARGPPARAPPARD
SCHEMBL14053267 0.84 PPARG (0.39) TP53MAPTPPARGPPARAPPARD
SCHEMBL15520414 0.84 NOD1 (0.38) PPARGPPARAPPARDRORCHTR6
SCHEMBL15519365 0.84 PPARG (0.41) TP53MAPTPPARGPPARAPPARD
SCHEMBL14054467 0.83 PPARG (0.41) TP53MAPTPPARGPPARAPPARD
SCHEMBL14053482 0.81 TP53 (0.42) TP53MAPTPPARGPPARAPPARD
SCHEMBL15519812 0.81 TRPM8 (0.37) TP53MAPTPPARGPPARAPPARD
SCHEMBL14054162 0.81 TP53 (0.38) TP53MAPTPPARGPPARAPPARD
SCHEMBL14053991 0.81 TP53 (0.38) TP53MAPTPPARGPPARAPPARD
SCHEMBL14053616 0.80 TP53 (0.42) TP53MAPTPPARGPPARAPPARD

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
EP-2521727-B1 NEW BENZOIC PYRROLOPYRIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PARKINSON'S DISEASE INVENTIVA (FR) 2014-03-19 — — EP claimed
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