SCHEMBL14157397

SCHEMBL14157397

CS(=O)(=O)c1ccccc1C(N)=S

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.50
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CA5A P35218 1/20 0.41
LMNA P02545 2/20 0.40
F2 P00734 3/20 0.40
PRSS1 P07477 3/20 0.40
PRSS2 P07478 3/20 0.40
PRSS3 P35030 3/20 0.40
EED O75530 1/20 0.38
PABPC1 P11940 1/20 0.38
EIF4H Q15056 1/20 0.38
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36

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
SCHEMBL6888900 0.83 GAA (0.46) CA1CA2CA9CA5ALMNA
SCHEMBL15270664 0.82 TTR (0.41) CA1CA2CA9CA5AF2
SCHEMBL364343 0.82 BCAT2 (0.56) BCAT2CA1CA2CA9CA5A
SCHEMBL3555054 0.80 BCAT2 (0.50) BCAT2CA1CA2CA9CA5A
Hydrochloric Acid SCHEMBL27374126 0.80 BCAT2 (0.54) BCAT2CA1CA2CA9CA5A
SCHEMBL2746745 0.78 BCAT2 (0.56) BCAT2CA1CA2CA9CA5A
SCHEMBL4321077 0.77 BCAT2 (0.59) BCAT2CA1CA2CA9CA5A
SCHEMBL34748 0.75 BCAT2 (0.62) BCAT2CA1CA2CA9LMNA
SCHEMBL29838630 0.75 BCAT2 (0.62) BCAT2CA1CA2CA9LMNA
SCHEMBL30455577 0.75 BCAT2 (0.62) BCAT2CA1CA2CA9CA5A

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
EP-2718279-A1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 Rhizen Pharmaceuticals S.A. (CH) 2014-04-16 EP disclosed
WO-2012170867-A1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2012-12-13 WO disclosed