SCHEMBL29464459

SCHEMBL29464459

CCCc1ccccc1-c1nc(NS(=O)(=O)c2cccc(N3CCCC(C)(C(=O)O)C3)n2)ccc1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.32
EIF2AK4 Q9P2K8 1/20 0.31
BTK Q06187 2/20 0.31
SCN1A P35498 2/20 0.31
SCN8A Q9UQD0 2/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31
KIF18A Q8NI77 2/20 0.30
EPHX2 P34913 1/20 0.30
S1PR1 P21453 1/20 0.30

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
SCHEMBL29464305 1.00 SCN9A (0.32) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19927721 1.00 SCN9A (0.32) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL29464531 1.00 SCN9A (0.32) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19951413 1.00 SCN9A (0.32) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19951451 1.00 SCN9A (0.32) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19925421 0.95 SCN9A (0.33) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19951401 0.95 SCN9A (0.33) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19925420 0.94 SCN9A (0.33) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19925426 0.93 EPHX2 (0.34) SCN9AEIF2AK4BTKSCN1ASCN8A
SCHEMBL19951366 0.91 RORC (0.33) SCN9ASCN1ASCN8ARORCKIF18A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN claimed
CN-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN disclosed