SCHEMBL26103564

SCHEMBL26103564

CCN1CCC(COc2cc3ncnc(-c4ccc(NC(=O)C(C)(C)c5ccc(F)cc5)cc4)c3cc2OC)CC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 5/20 0.51
▸ KDR P35968 3/20 0.49
▸ EGFR P00533 5/20 0.49
▸ PDGFRB P09619 5/20 0.47
▸ AURKA O14965 1/20 0.45
▸ PDGFRA P16234 1/20 0.44
▸ RAF1 P04049 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ MET P08581 2/20 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
SCHEMBL30395126 1.00 KIT (0.51) KITKDREGFRPDGFRBAURKA
SCHEMBL26100883 0.92 KIT (0.51) KITKDREGFRPDGFRBAURKA
SCHEMBL26101038 0.89 RAF1 (0.48) KITKDREGFRPDGFRBPDGFRA
SCHEMBL26101812 0.86 EGFR (0.52) KITKDREGFRPDGFRBPDGFRA
SCHEMBL26535219 0.85 KIT (0.50) KITKDREGFRPDGFRBAURKA
SCHEMBL30394404 0.84 AURKA (0.47) KITKDREGFRPDGFRBAURKA
SCHEMBL26536066 0.84 AURKA (0.47) KITKDREGFRPDGFRBAURKA
SCHEMBL26103044 0.84 AURKA (0.47) KITKDREGFRPDGFRBAURKA
SCHEMBL26103561 0.84 EGFR (0.45) KITKDREGFRPDGFRBAURKA
SCHEMBL29238270 0.80 AURKA (0.46) KITKDREGFRPDGFRBAURKA

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
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
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