SCHEMBL6971358

SCHEMBL6971358

COc1cc2cnc(Nc3ccc(Cl)cc3F)nc2cc1OCC1CO1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 4/20 0.53
EPHB4 P54760 3/20 0.52
KDR P35968 13/20 0.49
FLT1 P17948 12/20 0.49
FGFR1 P11362 10/20 0.49
EGFR P00533 8/20 0.47
FLT4 P35916 7/20 0.47
ERBB2 P04626 1/20 0.46
SRC P12931 1/20 0.46
EPHB2 P29323 1/20 0.46
NUDT1 P36639 2/20 0.44
CSF1R P07333 1/20 0.43

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
SCHEMBL5446461 0.80 EPHA2 (0.79) EPHA2EPHB4KDRFLT1FGFR1
SCHEMBL6478625 0.79 EGFR (0.51) KDRFLT1FGFR1EGFRFLT4
SCHEMBL3692729 0.77 FGFR1 (0.49) EPHA2KDRFLT1FGFR1EGFR
Hydrochloric Acid SCHEMBL7086434 0.76 EGFR (0.43) KDRFLT1FGFR1EGFRFLT4
SCHEMBL7797258 0.74 KDR (0.59) EPHA2EPHB4KDRFLT1FGFR1
SCHEMBL3668398 0.73 EGFR (0.69) EPHA2EPHB4KDRFLT1FGFR1
SCHEMBL7791030 0.73 FLT1 (0.55) KDRFLT1FGFR1EGFRCSF1R
SCHEMBL3677683 0.70 KDR (0.45) KDRFLT1FGFR1EGFRFLT4
SCHEMBL7801861 0.70 KDM4E (0.55) KDRFLT1EGFRSRCCSF1R
SCHEMBL4674469 0.70 DRD4 (0.60)

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-1274692-A1 QUINAZOLINE COMPOUNDS AstraZeneca AB (SE) 2003-01-15 EP disclosed
WO-2001077085-A1 QUINAZOLINE COMPOUNDS ASTRAZENECA AB (SE) 2001-10-18 WO disclosed