SCHEMBL26100211

SCHEMBL26100211

COc1cc2c(-c3ccc(NC(=O)Cc4ccc(C(F)(F)F)c(F)c4)cc3)ncnc2cc1OCC1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 7/20 0.47
▸ FLT4 P35916 6/20 0.47
▸ EGFR P00533 5/20 0.47
▸ FGFR1 P11362 5/20 0.47
▸ FLT1 P17948 5/20 0.47
▸ CSF1R P07333 3/20 0.46
▸ PDGFRB P09619 3/20 0.46
▸ KIT P10721 3/20 0.46
▸ PDGFRA P16234 2/20 0.46
▸ RET P07949 1/20 0.46
▸ DDR1 Q08345 1/20 0.46
▸ RAF1 P04049 4/20 0.43
▸ BRAF P15056 4/20 0.43
▸ AXL P30530 1/20 0.43
▸ TYRO3 Q06418 1/20 0.43
▸ MERTK Q12866 1/20 0.43
▸ EPHA2 P29317 1/20 0.43
▸ FLT3 P36888 1/20 0.42
▸ MET P08581 1/20 0.42

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
SCHEMBL30394312 1.00 KDR (0.47) KDRFLT4EGFRFGFR1FLT1
SCHEMBL26535078 0.91 KIT (0.57) KDRFLT4EGFRFGFR1FLT1
SCHEMBL26102350 0.90 KDR (0.46) KDRFLT4EGFRFGFR1FLT1
SCHEMBL26536043 0.90 KDR (0.46) KDRFLT4EGFRFGFR1FLT1
SCHEMBL30891790 0.90 KDR (0.46) KDRFLT4EGFRFGFR1FLT1
SCHEMBL29238260 0.90 KDR (0.45) KDRFLT4EGFRCSF1RPDGFRB
SCHEMBL29238236 0.88 KIT (0.47) KDRFLT4EGFRFGFR1FLT1
SCHEMBL30394321 0.88 KIT (0.47) KDRFLT4EGFRFGFR1FLT1
SCHEMBL30394313 0.88 AURKA (0.48) KDRFLT4EGFRFGFR1FLT1
SCHEMBL29238237 0.88 AURKA (0.48) KDRFLT4EGFRFGFR1FLT1

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