SCHEMBL4753630

SCHEMBL4753630

CSc1c(-c2ccc3nc(N)ncc3c2)ccc(C(=O)O)c1-c1ccc2nc(N)ncc2c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LCK P06239 19/20 0.47
KDR P35968 9/20 0.47
JAK3 P52333 5/20 0.47
MAPK14 Q16539 5/20 0.47
KIT P10721 12/20 0.43
SRC P12931 11/20 0.43
TEK Q02763 3/20 0.39
BRAF P15056 1/20 0.39

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
SCHEMBL21416962 0.78 LCK (0.53) LCKKDRJAK3MAPK14KIT
SCHEMBL5489077 0.76 LCK (0.50) LCKKDRJAK3MAPK14KIT
SCHEMBL5492585 0.71 LCK (0.59) LCKKDRJAK3MAPK14KIT
SCHEMBL5488850 0.71 LCK (0.62) LCKKDRJAK3MAPK14KIT
SCHEMBL4753607 0.68 DHFR (0.45)
SCHEMBL5496333 0.67 LCK (0.59) LCKKDRJAK3MAPK14KIT
SCHEMBL42089 0.67 LCK (0.73) LCKKDRJAK3MAPK14KIT
SCHEMBL14715547 0.67 LCK (0.68) LCKKDRJAK3MAPK14KIT
SCHEMBL5492816 0.67 LCK (0.72) LCKKDRJAK3MAPK14KIT
SCHEMBL23559590 0.66 TDP1 (0.50) LCKKDRJAK3MAPK14KIT

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
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO claimed
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO disclosed