SCHEMBL26098297

SCHEMBL26098297

COc1cc2c(-c3ccc(CC(N)=O)cc3)ncnc2cc1OCC1CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.51
▸ KDR P35968 7/20 0.51
▸ FGFR1 P11362 5/20 0.51
▸ FLT1 P17948 5/20 0.51
▸ FLT4 P35916 5/20 0.51
▸ KIT P10721 5/20 0.51
▸ AXL P30530 1/20 0.47
▸ TYRO3 Q06418 1/20 0.47
▸ MERTK Q12866 1/20 0.47
▸ ENPP1 P22413 2/20 0.47
▸ IRAK4 Q9NWZ3 1/20 0.45
▸ RAF1 P04049 1/20 0.44
▸ EPHA2 P29317 2/20 0.42
▸ EPHB4 P54760 2/20 0.42
▸ ERBB2 P04626 1/20 0.42
▸ EP300 Q09472 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
SCHEMBL26100098 0.89 EGFR (0.56) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26101805 0.87 KIT (0.46) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26102144 0.86 EGFR (0.46) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26099698 0.85 KDR (0.47) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26099430 0.85 KIT (0.48) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26102114 0.85 KIT (0.51) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26101262 0.84 KDR (0.51) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26101865 0.83 KDR (0.45) EGFRKDRFGFR1FLT1FLT4
SCHEMBL26102116 0.83 KIT (0.52) EGFRKDRFGFR1FLT1FLT4
SCHEMBL30891790 0.83 KDR (0.46) EGFRKDRFGFR1FLT1FLT4

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
WO-2023075529-A1 QUINAZOLINE DERIVATIVE COMPOUND AND USE THEREOF 보로노이바이오 주식회사 2023-05-04 — — WO claimed
WO-2023075529-A1 QUINAZOLINE DERIVATIVE COMPOUND AND USE THEREOF 보로노이바이오 주식회사 2023-05-04 — — WO disclosed
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