SCHEMBL19996409

SCHEMBL19996409

CC(F)c1cc(S(=O)(=O)C(C)(F)C2CCN(C(=O)Nc3ccnnc3)CC2)n(C)n1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SPR P35270 1/20 0.35
TRPV1 Q8NER1 7/20 0.35
RORC P51449 1/20 0.33
SCN10A Q9Y5Y9 2/20 0.33
NAMPT P43490 1/20 0.33
GAA P10253 1/20 0.33
EPHX2 P34913 1/20 0.32
FAAH O00519 1/20 0.32
PANK3 Q9H999 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL17949310 0.94 SPR (0.36) SPRTRPV1RORCSCN10ANAMPT
SCHEMBL19996416 0.92 LMNA (0.34) SPRTRPV1RORCNAMPTGAA
SCHEMBL19996410 0.88 TRPV1 (0.38) SPRTRPV1RORCNAMPTGAA
SCHEMBL17949351 0.87 TRPV1 (0.38) SPRTRPV1RORCNAMPTGAA
SCHEMBL17942440 0.87 TRPV1 (0.36) SPRTRPV1RORCSCN10ANAMPT
SCHEMBL19996439 0.87 TRPV1 (0.38) SPRTRPV1RORCNAMPTGAA
SCHEMBL17948928 0.86 LMNA (0.35) SPRTRPV1RORCNAMPTGAA
SCHEMBL17949465 0.83 TRPV1 (0.37) SPRTRPV1RORCNAMPTGAA
SCHEMBL29529794 0.83 TRPV1 (0.37) SPRTRPV1RORCNAMPTGAA
SCHEMBL19996431 0.82 CNR2 (0.35) SPRFAAH

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
US-9925177-B2 4-methylsulfonyl-substituted piperidine urea compounds MyoKardia, Inc. (US) 2018-03-27 US disclosed