SCHEMBL29464465

SCHEMBL29464465

Cc1ccccc1-c1nc(NS(=O)(=O)c2cccc(N3CCNC[C@H]3C(=O)O)n2)ccc1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 9/20 0.34
HTR2B P41595 7/20 0.34
HTR2A P28223 5/20 0.32
SCN9A Q15858 2/20 0.32
SCN1A P35498 2/20 0.32
SCN8A Q9UQD0 2/20 0.32
SFRP1 Q8N474 2/20 0.31
FPR2 P25090 1/20 0.31
CCNT1 O60563 1/20 0.31
CCNK O75909 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
CDK9 P50750 1/20 0.31
CDK12 Q9NYV4 1/20 0.31
KCNH2 Q12809 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
SCHEMBL29464547 1.00 HTR2C (0.34) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL19925202 1.00 HTR2C (0.34) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL29464957 1.00 HTR2C (0.34) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL19927715 1.00 HTR2C (0.34) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL29464512 0.90 HTR2C (0.40) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL19951341 0.90 HTR2C (0.40) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL29464303 0.90 HTR2C (0.40) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL19951343 0.90 HTR2C (0.40) HTR2CHTR2BHTR2ASCN9ASCN1A
SCHEMBL19968833 0.90 HTR2C (0.40) HTR2CHTR2BHTR2ASCN9ASCN1A
Hydrochloric Acid SCHEMBL19951372 0.89 HTR2C (0.40) HTR2CHTR2BHTR2ASCN9ASCN1A

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