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SCHEMBL16573189

SCHEMBL16573189

CCCN(CCCC(CC)C1CC1)c1cncc(-c2cn(-c3c(F)ccc(NS(=O)(=O)c4ccoc4)c3F)nn2)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 11/20 0.43
▸ MAP3K20 Q9NYL2 19/20 0.39
▸ LCK P06239 2/20 0.37
▸ LIMK1 P53667 2/20 0.37
▸ LIMK2 P53671 2/20 0.37
▸ RIPK2 O43353 1/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ BLK P51451 1/20 0.37

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
SCHEMBL16573196 0.94 BRAF (0.36) BRAFMAP3K20LCKLIMK1LIMK2
SCHEMBL16573206 0.89 BRAF (0.46) BRAFMAP3K20LCKLIMK1LIMK2
SCHEMBL16573205 0.86 BRAF (0.45) BRAFMAP3K20
SCHEMBL16573185 0.86 BRAF (0.45) BRAFMAP3K20
SCHEMBL10129946 0.85 BRAF (0.42) BRAFMAP3K20LCKLIMK1LIMK2
SCHEMBL16573198 0.85 BRAF (0.47) BRAFMAP3K20LCKLIMK1LIMK2
SCHEMBL16573221 0.83 BRAF (0.43) BRAFMAP3K20
SCHEMBL16573195 0.82 MAP3K20 (0.40) BRAFMAP3K20LCKLIMK1LIMK2
SCHEMBL16573197 0.82 BRAF (0.39) BRAFMAP3K20
SCHEMBL10130221 0.79 MAP3K20 (0.37) BRAFMAP3K20LCKLIMK1LIMK2

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-2655355-B1 NEW TRIAZOLYLPHENYL SULFONAMIDES AS SERINE/THREONINE KINASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2015-03-18 — — EP disclosed