SCHEMBL17690441

SCHEMBL17690441

N#Cc1ccc(CNS(=O)(=O)c2ccc(NN)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.80
NAMPT P43490 2/20 0.59
CA1 P00915 6/20 0.52
CA2 P00918 6/20 0.52
CA12 O43570 5/20 0.52
CA9 Q16790 5/20 0.52
NSD2 O96028 1/20 0.50
CA7 P43166 2/20 0.49
CA4 P22748 2/20 0.49
CA6 P23280 1/20 0.49
CA5A P35218 1/20 0.49
CA5B Q9Y2D0 1/20 0.49
IDO1 P14902 1/20 0.47
LSS P48449 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL20946444 0.85 CYP19A1 (0.85) CYP19A1NAMPTCA1CA2CA12
SCHEMBL1169440 0.82 CYP19A1 (0.85) CYP19A1NAMPTNSD2LSSLMNA
SCHEMBL533496 0.82 CYP19A1 (0.85) CYP19A1NAMPTCA1CA2CA9
SCHEMBL4662881 0.82 CYP19A1 (0.84) CYP19A1NAMPTCA1CA2CA12
SCHEMBL120014 0.82 CYP19A1 (0.84) CYP19A1NAMPTCA1CA2CA12
SCHEMBL2762172 0.81 CA1 (0.74) CYP19A1NAMPTCA1CA2CA12
SCHEMBL7983897 0.80 CYP19A1 (0.80) CYP19A1NAMPTCA1CA2CA12
SCHEMBL5783946 0.79 CYP19A1 (0.79) CYP19A1NAMPTLMNA
SCHEMBL7986035 0.79 CYP19A1 (0.78) CYP19A1NAMPTNSD2LMNA
SCHEMBL7983776 0.79 CYP19A1 (0.78) CYP19A1NAMPTNSD2LMNA

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
EP-1505441-B1 Alkali-soluble polymer, polymerizable composition comprising the same, negative image-recording material and process for image forming FUJIFILM CORP (JP) 2016-04-20 EP disclosed