SCHEMBL16660494

SCHEMBL16660494

Fc1cnc(Cl)nc1Nc1ccc2c(c1)OOC(F)(F)C2(F)F

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.39
AURKA O14965 4/20 0.36
BCL6 P41182 4/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDR P35968 1/20 0.34
CDK1 P06493 1/20 0.34

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
SCHEMBL656863 0.82 SYK (0.43) SYKAURKABCL6ALDH1A1L3MBTL1
SCHEMBL654380 0.73 SYK (0.60) SYK
SCHEMBL656737 0.73 SYK (0.55) SYKAURKABCL6ALDH1A1L3MBTL1
SCHEMBL15764450 0.73 SYK (0.47) SYKBCL6
SCHEMBL653915 0.72 SYK (0.50) SYKAURKABCL6ALDH1A1L3MBTL1
SCHEMBL2102251 0.72 SYK (0.50) SYKAURKABCL6ALDH1A1L3MBTL1
SCHEMBL2103491 0.72 SYK (0.54) SYKBCL6KDR
SCHEMBL656721 0.71 SYK (0.56) SYKAURKAKDRCDK1
SCHEMBL656336 0.71 SYK (0.39) SYKAURKABCL6
SCHEMBL27612496 0.71 SYK (0.60) SYK

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-9018204-B1 2,4-pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2015-04-28 US disclosed