SCHEMBL6823529

SCHEMBL6823529

COc1ccc(COc2cc(OC(C)C)c3c(Nc4cc(OC)ncc4Cl)ncnc3c2)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 0.62
KDR P35968 14/20 0.55
EGFR P00533 1/20 0.51

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
SCHEMBL7128347 0.86 SRC (0.63) SRCKDREGFR
SCHEMBL6830967 0.86 SRC (0.67) SRCKDREGFR
Hydrochloric Acid SCHEMBL6823476 0.86 SRC (0.62) SRCKDREGFR
SCHEMBL6829415 0.85 SRC (0.60) SRCKDREGFR
SCHEMBL6829449 0.85 SRC (0.60) SRCKDREGFR
SCHEMBL6819711 0.84 SRC (0.72) SRCKDREGFR
SCHEMBL6922194 0.84 SRC (0.75) SRCKDREGFR
SCHEMBL6823640 0.84 EGFR (0.54) SRCKDREGFR
SCHEMBL3205180 0.82 SRC (0.55) SRCKDREGFR
SCHEMBL6823586 0.81 SRC (0.61) SRCKDREGFR

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
WO-2004056812-A1 4- (PYRIDIN-4-YLAMINO) -QUINAZOLINE DERIVATIVES AS ANTI-TUMOR AGENTS ASTRAZENECA AB (SE) 2004-07-08 WO disclosed