SCHEMBL7883378

SCHEMBL7883378

COc1cc2c(Nc3cc(-c4ccc(C)cc4)[nH]n3)ncnc2cc1OC(C)C1CCNCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 13/20 0.48
▸ KDR P35968 11/20 0.48
▸ FGFR1 P11362 5/20 0.48
▸ FLT1 P17948 5/20 0.48
▸ FLT4 P35916 5/20 0.48
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ AXL P30530 1/20 0.41
▸ TYRO3 Q06418 1/20 0.41
▸ MERTK Q12866 1/20 0.41
▸ USP2 O75604 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CLK4 Q9HAZ1 1/20 0.40
▸ RET P07949 1/20 0.40
▸ CLK1 P49759 1/20 0.40

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
SCHEMBL7881690 0.93 EGFR (0.48) EGFRKDRFGFR1FLT1FLT4
SCHEMBL7876965 0.93 EGFR (0.47) EGFRKDRFGFR1FLT1FLT4
SCHEMBL7882903 0.90 KDR (0.47) EGFRKDRFGFR1FLT1FLT4
SCHEMBL7883417 0.85 EGFR (0.51) EGFRKDRFGFR1FLT1FLT4
SCHEMBL2200924 0.80 KDR (0.74) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5565975 0.78 EGFR (0.68) EGFRKDRFGFR1FLT1FLT4
SCHEMBL7887944 0.77 EGFR (0.62) EGFRKDRFLT1KDM4EHTT
SCHEMBL5649183 0.76 EGFR (0.62) EGFRKDRFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL5561522 0.76 EGFR (0.63) EGFRKDRFLT1KDM4EHTT
SCHEMBL7885975 0.76 KDR (0.41) EGFRKDRFLT4RET

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-1119567-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2001-08-01 — — EP disclosed
WO-2000021955-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2000-04-20 — — WO disclosed
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