SCHEMBL15640935

SCHEMBL15640935

NS(=O)(=O)c1ccc2ncn(-c3ccccc3)c2c1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 9/20 0.58
SRC P12931 3/20 0.55
HTT P42858 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 1/20 0.54
MAPK1 P28482 1/20 0.54
MAPK10 P53779 1/20 0.54
NCOA1 Q15788 1/20 0.54
NCOA3 Q9Y6Q9 1/20 0.54
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49

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
SCHEMBL2058867 0.85 FGFR1 (0.61) FGFR1SRCHTTALDH1A1HPGD
SCHEMBL19848656 0.76 FGFR1 (0.76) FGFR1SRCHTTALDH1A1HPGD
SCHEMBL12822202 0.76 FGFR1 (0.62) FGFR1SRCHPGD
SCHEMBL23846263 0.75 FGFR1 (0.76) FGFR1SRCHTTALDH1A1HPGD
SCHEMBL20698049 0.74 HTT (0.65) FGFR1SRCHTTALDH1A1HPGD
SCHEMBL19911376 0.73 FGFR1 (1.00) FGFR1SRCHTTALDH1A1HPGD
SCHEMBL374942 0.73 FGFR1 (0.61) FGFR1SRCHTTALDH1A1HPGD
SCHEMBL1580271 0.73 HTT (0.79) FGFR1HTT
Sulfuric Acid SCHEMBL2295927 0.73 HTT (0.79) FGFR1HTT
SCHEMBL13993884 0.73 FGFR1 (0.76) FGFR1SRCHTTALDH1A1HPGD

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-8697739-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2014-04-15 US disclosed