SCHEMBL15450959

SCHEMBL15450959

Cc1ccc2nc(NS(C)(=O)=O)oc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 5/20 0.61
NPC1 O15118 7/20 0.49
LMNA P02545 3/20 0.49
MAPT P10636 6/20 0.49
KDM4E B2RXH2 4/20 0.49
HSD17B10 Q99714 3/20 0.46
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
AGTR1 P30556 1/20 0.44
OPRK1 P41145 1/20 0.44
MDM2 Q00987 1/20 0.44
HIF1A Q16665 1/20 0.44
RAB9A P51151 6/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TP53 P04637 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43

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
SCHEMBL128635 0.88 FBP1 (0.61) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL27827007 0.81 FBP1 (0.61) FBP1LMNAMAPTALDH1A1HPGD
SCHEMBL12829824 0.81 FBP1 (0.52) FBP1MAPTMEN1KMT2ATP53
SCHEMBL2134640 0.77 MAPT (0.54) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL1748081 0.76 KDM4E (0.53) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL15450923 0.75 PIK3CA (0.51) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL8034874 0.74 MAPT (0.56) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL11261015 0.73 MAPT (0.50) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL11258897 0.73 AGPAT2 (0.58) FBP1NPC1LMNAMAPTKDM4E
SCHEMBL8370275 0.72 NPC1 (0.66) NPC1MAPTKDM4EHSD17B10ALDH1A1

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-8637542-B2 Kinase inhibitors and methods of use INTELLIKINE, INC. (US) 2014-01-28 US disclosed