SCHEMBL6016642

SCHEMBL6016642

CNC(=O)Cc1n[nH]c2ccc(Nc3ncc(F)c(Nc4ccc5c(c4)OCCO5)n3)cc12

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.64
EGFR P00533 3/20 0.53
JAK2 O60674 1/20 0.46
LCK P06239 1/20 0.46
LYN P07948 1/20 0.46
FGFR4 P22455 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
SCHEMBL6016351 0.94 SYK (0.64) SYKEGFRJAK2LCKLYN
SCHEMBL6016415 0.90 SYK (0.59) SYKEGFR
SCHEMBL6016285 0.90 SYK (0.59) SYKEGFR
SCHEMBL6016559 0.86 SYK (0.64) SYKEGFR
SCHEMBL6016192 0.84 SYK (0.62) SYKEGFR
SCHEMBL6016257 0.84 SYK (0.59) SYKEGFR
SCHEMBL6016702 0.84 SYK (0.59) SYKEGFR
SCHEMBL6016130 0.84 SYK (0.55) SYKEGFR
SCHEMBL6016430 0.84 SYK (0.55) SYKEGFR
SCHEMBL6016718 0.83 SYK (0.69) SYKEGFR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1471915-A4 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2006-02-15 EP disclosed
EP-1471915-A2 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2004-11-03 EP disclosed
WO-2003063794-A2 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2003-08-07 WO disclosed