SCHEMBL29153400

SCHEMBL29153400

COc1cc2ncnc(Oc3ccc4c(C(=O)NC(C)C)c(C)oc4c3)c2cc1OCc1ccc(C(=O)NO)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 16/20 0.68
▸ FLT4 P35916 6/20 0.68
▸ FLT1 P17948 3/20 0.68
▸ PDGFRB P09619 4/20 0.48
▸ MET P08581 4/20 0.45
▸ AURKA O14965 3/20 0.45
▸ TEK Q02763 3/20 0.45
▸ AURKB Q96GD4 3/20 0.45
▸ PDGFRA P16234 1/20 0.45
▸ RAF1 P04049 1/20 0.44
▸ KIT P10721 1/20 0.44
▸ SRC P12931 1/20 0.44
▸ CSF1R P07333 1/20 0.44
▸ FLT3 P36888 1/20 0.43
▸ BRAF P15056 1/20 0.43

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
SCHEMBL30753477 1.00 KDR (0.68) KDRFLT4FLT1PDGFRBMET
SCHEMBL30753468 0.91 KDR (0.68) KDRFLT4FLT1PDGFRBMET
SCHEMBL29153414 0.91 KDR (0.68) KDRFLT4FLT1PDGFRBMET
SCHEMBL29153406 0.90 KDR (0.64) KDRFLT4FLT1PDGFRBMET
SCHEMBL29153409 0.90 KDR (0.64) KDRFLT4FLT1PDGFRBMET
SCHEMBL30753471 0.90 KDR (0.64) KDRFLT4FLT1PDGFRBMET
SCHEMBL11931698 0.90 KDR (0.83) KDRFLT4FLT1METAURKA
SCHEMBL29153415 0.89 KDR (0.59) KDRFLT4FLT1PDGFRBMET
SCHEMBL30753460 0.84 KDR (0.67) KDRFLT4FLT1
SCHEMBL30753459 0.84 KDR (0.67) KDRFLT4FLT1

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-117285518-A Quinazoline derivative containing benzofuran structure and application thereof 华侨大学 2023-12-26 — — CN claimed
CN-117285518-A Quinazoline derivative containing benzofuran structure and application thereof 华侨大学 2023-12-26 — — CN disclosed
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