SCHEMBL6829440

SCHEMBL6829440

COc1cnc(Cl)c(Nc2ncnc3cc(OCCN4CCN(C(C)=O)CC4)cc(OC(C)C)c23)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 1.00
KDR P35968 18/20 1.00
EGFR P00533 1/20 0.41

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
SCHEMBL6924183 0.89 SRC (0.80) SRCKDREGFR
SCHEMBL6823949 0.87 SRC (0.77) SRCKDR
SCHEMBL6829362 0.87 SRC (1.00) SRCKDR
SCHEMBL6829338 0.86 SRC (0.75) SRCKDREGFR
SCHEMBL6825683 0.84 SRC (0.74) SRCKDREGFR
SCHEMBL7128594 0.82 SRC (0.69) SRCKDREGFR
SCHEMBL6829226 0.82 SRC (0.69) SRCKDREGFR
SCHEMBL3194213 0.82 SRC (0.69) SRCKDR
Azd-0424 SCHEMBL29382167 0.80 SRC (0.73) SRCKDREGFR
Azd-0424 SCHEMBL3202072 0.80 SRC (0.73) 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-2004108711-A1 PYRAZINIL QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF TUMOURS ASTRAZENECA AB (SE) 2004-12-16 WO disclosed