SCHEMBL26697248

SCHEMBL26697248

COc1cc2c(Oc3ccc(NC(=O)Nc4ccc(C(F)(F)F)cc4)c(Cl)c3)ncnc2cc1OCc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.73
FLT1 P17948 10/20 0.73
FLT4 P35916 10/20 0.73
BRAF P15056 3/20 0.67
RAF1 P04049 1/20 0.65
MAPK14 Q16539 1/20 0.63
TNNI3K Q59H18 1/20 0.63
CSF1R P07333 1/20 0.61
KIT P10721 1/20 0.60
PDGFRA P16234 1/20 0.60

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
SCHEMBL26697292 0.93 KDR (0.75) KDRFLT1FLT4BRAFRAF1
SCHEMBL26697210 0.93 KDR (0.73) KDRFLT1FLT4BRAFCSF1R
SCHEMBL26697235 0.92 KDR (0.73) KDRFLT1FLT4BRAFCSF1R
SCHEMBL26894823 0.92 KDR (0.67) KDRFLT1FLT4BRAFCSF1R
SCHEMBL26697214 0.91 KDR (0.74) KDRFLT1FLT4BRAFRAF1
SCHEMBL26697244 0.91 KDR (0.72) KDRFLT1FLT4BRAFCSF1R
SCHEMBL26894914 0.91 KDR (0.76) KDRFLT1FLT4BRAFCSF1R
SCHEMBL26697250 0.91 KDR (0.72) KDRFLT1FLT4BRAFCSF1R
SCHEMBL26894917 0.88 KDR (0.73) KDRFLT1FLT4CSF1RKIT
SCHEMBL26894873 0.87 KDR (0.72) KDRFLT1FLT4BRAFRAF1

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