SCHEMBL2580732

SCHEMBL2580732

[CH2]COc1ccc(Nc2ncc3cc(-c4cc(O)ccc4Cl)cc(C)c3n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 0.55
ABL1 P00519 7/20 0.55
PDGFRB P09619 5/20 0.55
YES1 P07947 3/20 0.55
KDR P35968 3/20 0.55
EPHB4 P54760 2/20 0.55
CIT O14578 1/20 0.55
GAK O14976 1/20 0.55
EPHB6 O15197 1/20 0.55
RIPK2 O43353 1/20 0.55
PRKD3 O94806 1/20 0.55
LCK P06239 1/20 0.55
RET P07949 1/20 0.55
BCR P11274 1/20 0.55
BRAF P15056 1/20 0.55
EPHA2 P29317 1/20 0.55
EPHB2 P29323 1/20 0.55
TYK2 P29597 1/20 0.55
ACVR1B P36896 1/20 0.55
TGFBR1 P36897 1/20 0.55

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
SCHEMBL231130 0.84 SRC (0.78) SRCABL1PDGFRBYES1KDR
SCHEMBL229189 0.79 SRC (0.54) SRCABL1PDGFRBYES1KDR
SCHEMBL229760 0.78 SRC (0.58) SRCABL1PDGFRBYES1KDR
SCHEMBL229759 0.78 SRC (0.58) SRCABL1PDGFRBYES1KDR
SCHEMBL230633 0.78 SRC (0.49) SRCABL1PDGFRBYES1KDR
SCHEMBL230632 0.78 SRC (0.49) SRCABL1PDGFRBYES1KDR
SCHEMBL231132 0.76 ALK (0.58) SRCABL1PDGFRBYES1KDR
SCHEMBL2579072 0.76 SRC (0.52) SRCABL1PDGFRBYES1KDR
SCHEMBL226225 0.73 SRC (0.55) SRCABL1PDGFRBYES1KDR
SCHEMBL229295 0.73 SRC (0.60) SRCABL1PDGFRBYES1KDR

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-2381943-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS Fovea Pharmaceuticals (FR) 2011-11-02 EP claimed
WO-2010076238-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS FOVEA PHARMACEUTICALS SA (FR) 2010-07-08 WO claimed