SCHEMBL6656677

SCHEMBL6656677

CC(NC1=NS(=O)(=O)c2cnccc2N1)C(C)(F)F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 1/20 0.33
LATS2 Q9NRM7 1/20 0.33
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL2337867 0.90 PLK1 (0.36) LATS1LATS2CA12CA1CA2
SCHEMBL8626480 0.84 CA12 (0.36) LATS1LATS2CA12CA1CA2
SCHEMBL6620058 0.84 CXCR2 (0.31) LATS1LATS2CA12CA1CA2
SCHEMBL2341320 0.82 CA12 (0.34) CA12CA1CA2CA9CA14
SCHEMBL4264934 0.80 LATS1 (0.40) LATS1LATS2CA12CA1CA2
SCHEMBL6619437 0.79 CXCR2 (0.35) LATS1LATS2CA12CA1CA2
SCHEMBL6618235 0.78 KDM4C (0.44) LATS1LATS2CA12CA1CA2
SCHEMBL6618264 0.78 KDM4C (0.44) LATS1LATS2CA12CA1CA2
SCHEMBL6618236 0.78 KDM4C (0.44) LATS1LATS2CA12CA1CA2
SCHEMBL6617764 0.77 HCAR3 (0.38) CA12CA1CA2CA9

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-0877748-B1 PYRIDO-1,2,4-THIADIAZINE AND PYRIDO-1,4-THIAZINE DERIVATIVES, THEIR PREPARATION AND USE UNIV LIEGE (BE) 2004-11-03 EP disclosed
US-5792764-A ENDOCRINE DISORDERS ESPECIALLY AS A K(ATP)-CHANNEL MODULATOR NOVO NORDISK A/S (DK) 1998-08-11 US disclosed