SCHEMBL12334253

SCHEMBL12334253

Cc1cc(F)ccc1C(=O)Nc1ccc(C(C)(O)C(F)(F)F)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SCN8A Q9UQD0 2/20 0.45
▸ SCN10A Q9Y5Y9 2/20 0.45
▸ HSD11B1 P28845 1/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ KIT P10721 1/20 0.44

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
SCHEMBL12334252 0.88 SNCA (0.56) KMT2AHSD11B1
SCHEMBL12334244 0.86 TRPV1 (0.50) TRPV1KIT
SCHEMBL12334266 0.83 HPGD (0.60) MEN1KMT2AHSD11B1
SCHEMBL12334628 0.81 GPR27 (0.58) KMT2ATRPV1
SCHEMBL12334059 0.77 MEN1 (0.67) MEN1KMT2A
SCHEMBL12334262 0.76 TRPV1 (0.74) MEN1KMT2ATRPV1
SCHEMBL12334247 0.76 RAB9A (0.48) MEN1KMT2AHSD11B1TRPV1
SCHEMBL20956394 0.76 PDK1 (0.54) MEN1KMT2AHSD11B1TRPV1
SCHEMBL3419156 0.76 PDK1 (0.54) MEN1KMT2AHSD11B1TRPV1
SCHEMBL19180948 0.76 PDK1 (0.54) MEN1KMT2AHSD11B1TRPV1

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-2011115892-A1 MODULATORS OF THE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTORS GRIFFIN PATRICK R (US) 2011-09-22 — — WO disclosed
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