SCHEMBL30891766

SCHEMBL30891766

COCCN1CCC(COc2cc3ncnc(-c4ccc(NC(C)=O)c(F)c4)c3cc2OC)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 13/20 0.51
▸ EGFR P00533 12/20 0.51
▸ FGFR1 P11362 9/20 0.51
▸ FLT1 P17948 9/20 0.51
▸ FLT4 P35916 9/20 0.51
▸ KIT P10721 5/20 0.51
▸ PDGFRB P09619 2/20 0.51
▸ TEK Q02763 2/20 0.51
▸ RET P07949 2/20 0.51
▸ KIF5B P33176 2/20 0.51
▸ BMPR1B O00238 1/20 0.51
▸ PLK4 O00444 1/20 0.51
▸ CIT O14578 1/20 0.51
▸ GAK O14976 1/20 0.51
▸ EPHB6 O15197 1/20 0.51
▸ RIPK2 O43353 1/20 0.51
▸ ROCK2 O75116 1/20 0.51
▸ STK10 O94804 1/20 0.51
▸ MAP4K4 O95819 1/20 0.51
▸ ABL1 P00519 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
SCHEMBL26099433 0.88 EGFR (0.52) KDREGFRKITPDGFRBFLT3
SCHEMBL30394281 0.88 EGFR (0.52) KDREGFRKITPDGFRBFLT3
SCHEMBL26534393 0.85 PDGFRB (0.46) KDREGFRFGFR1FLT1FLT4
SCHEMBL26099032 0.82 EGFR (0.51) KDREGFRKITPDGFRBROCK2
SCHEMBL26103039 0.82 EGFR (0.50) KDREGFRKITPDGFRBCSF1R
SCHEMBL26100864 0.81 KIT (0.44) KDREGFRFGFR1FLT1FLT4
SCHEMBL26099430 0.81 KIT (0.48) KDREGFRFGFR1FLT1FLT4
SCHEMBL26100883 0.80 KIT (0.51) KDREGFRFLT1FLT4KIT
SCHEMBL26103035 0.80 KIT (0.46) KDREGFRFGFR1FLT1FLT4
SCHEMBL29238247 0.80 KIT (0.50) KDREGFRFGFR1FLT1FLT4

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
CN-118201909-A Quinazoline derivative compound and use thereof 株式会社沃若诺伊 2024-06-14 — — CN claimed
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