SCHEMBL15519812

SCHEMBL15519812

Cc1cc(Cc2cc3cc(C(F)(F)F)cnc3n2S(=O)(=O)c2cccc(C(C)(C)C)c2)ccc1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 5/20 0.37
▸ PPARG P37231 5/20 0.36
▸ PPARA Q07869 4/20 0.36
▸ PPARD Q03181 3/20 0.36
▸ NR1H4 Q96RI1 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ RORC P51449 3/20 0.34
▸ CPT2 P23786 1/20 0.34
▸ CPT1A P50416 1/20 0.34
▸ CPT1B Q92523 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 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
SCHEMBL14054035 0.90 TRPM8 (0.44) TRPM8PPARGPPARAPPARDNR1H4
SCHEMBL15519981 0.89 TRPM8 (0.36) TRPM8PPARGPPARAPPARDRORC
SCHEMBL15519263 0.85 TRPM8 (0.38) TRPM8PPARGPPARAPPARDGAA
SCHEMBL14058225 0.85 RORC (0.39) TRPM8PPARGPPARAPPARDPOLB
SCHEMBL15519810 0.84 TRPM8 (0.43) TRPM8PPARGPPARAPPARDRORC
SCHEMBL15519729 0.82 MEN1 (0.37) TRPM8MEN1GAAKMT2ARORC
SCHEMBL15519366 0.81 TP53 (0.37) TRPM8PPARGPPARAPPARDNR1H4
SCHEMBL15519780 0.81 PPARG (0.42) TRPM8PPARGPPARAPPARDKMT2A
SCHEMBL14053670 0.79 TRPM8 (0.40) TRPM8PPARGPPARAPPARDRORC
SCHEMBL15519728 0.79 TRPM8 (0.42) TRPM8PPARGNR1H4L3MBTL1TP53

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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