SCHEMBL7846902

SCHEMBL7846902

COc1cc2c(Oc3ccc4ccc(C)nc4c3)ncnc2cc1OC(C)C1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 14/20 0.45
▸ EGFR P00533 3/20 0.45
▸ LCK P06239 2/20 0.44
▸ RET P07949 1/20 0.44
▸ KIF5B P33176 1/20 0.44
▸ AURKA O14965 2/20 0.44
▸ MET P08581 2/20 0.44
▸ TEK Q02763 2/20 0.44
▸ AURKB Q96GD4 2/20 0.44
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ PDE10A Q9Y233 1/20 0.43
▸ PDGFRA P16234 2/20 0.42
▸ KIT P10721 1/20 0.42
▸ KDM1A O60341 1/20 0.41
▸ RAF1 P04049 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
SCHEMBL7847135 0.83 KDR (0.45) KDREGFRLCKRETKIF5B
SCHEMBL6366468 0.83 KDR (0.43) KDREGFRLCKRETKIF5B
SCHEMBL7845204 0.80 KDR (0.45) KDREGFRLCKRETKIF5B
SCHEMBL7848071 0.80 KDM1A (0.47) KDREGFRLCKRETKIF5B
SCHEMBL7885975 0.77 KDR (0.41) KDREGFRLCKRETKIF5B
SCHEMBL7850002 0.76 KDR (0.43) KDREGFRLCKRETKIF5B
SCHEMBL4374206 0.76 EGFR (0.59) KDREGFRKITRAF1
SCHEMBL4371957 0.76 KDR (0.58) KDREGFRLCKPDGFRAKIT
SCHEMBL7837879 0.76 KDR (0.47) KDREGFRLCKRETKIF5B
SCHEMBL7848549 0.76 RAF1 (0.42) KDRRETKIF5BAURKAMET

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-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 — — EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 — — WO disclosed
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