SCHEMBL26697263

SCHEMBL26697263

COc1cc2c(Oc3ccc(NC(=O)Nc4ccc(Br)cc4F)c(Cl)c3)ncnc2cc1OCc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.73
FLT1 P17948 9/20 0.73
FLT4 P35916 9/20 0.73
KIT P10721 1/20 0.61
PDGFRA P16234 1/20 0.61

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
SCHEMBL26697235 0.88 KDR (0.73) KDRFLT1FLT4KITPDGFRA
SCHEMBL26697326 0.88 KDR (0.73) KDRFLT1FLT4KITPDGFRA
SCHEMBL26894823 0.88 KDR (0.67) KDRFLT1FLT4KITPDGFRA
SCHEMBL26697264 0.88 KDR (0.71) KDRFLT1FLT4KITPDGFRA
SCHEMBL26894917 0.87 KDR (0.73) KDRFLT1FLT4KITPDGFRA
SCHEMBL26697289 0.87 KDR (0.70) KDRFLT1FLT4KITPDGFRA
SCHEMBL26697219 0.87 KDR (0.78) KDRFLT1FLT4PDGFRA
SCHEMBL26894877 0.86 KDR (0.65) KDRFLT1FLT4KITPDGFRA
SCHEMBL29757938 0.86 KDR (0.65) KDRFLT1FLT4KITPDGFRA
SCHEMBL5208712 0.86 KDR (0.68) KDRFLT1FLT4KITPDGFRA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114920703-B Quinazoline derivative and preparation method and application thereof 天津济坤医药科技有限公司 2024-01-09 CN disclosed
WO-2023226323-A1 QUINAZOLINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 天津济坤医药科技有限公司 2023-11-30 WO disclosed
WO-2023226323-A1 QUINAZOLINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 天津济坤医药科技有限公司 2023-11-30 WO disclosed
CN-114920703-A Quinazoline derivative and preparation method and application thereof 天津济坤医药科技有限公司 2022-08-19 CN disclosed