SCHEMBL25912909

SCHEMBL25912909

COc1nc(NC(C)C)ncc1-c1ccc2cc(Oc3ccnc(NC(C)=O)c3)ccc2n1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 2/20 0.50
▸ CSF1R P07333 2/20 0.50
▸ PDGFRA P16234 2/20 0.50
▸ RIOK2 Q9BVS4 3/20 0.41
▸ BRAF P15056 13/20 0.41
▸ MAPK14 Q16539 2/20 0.37
▸ MAPK13 O15264 1/20 0.37
▸ LCK P06239 1/20 0.37
▸ FYN P06241 1/20 0.37
▸ KIT P10721 1/20 0.37
▸ SRC P12931 1/20 0.37
▸ FLT1 P17948 1/20 0.37
▸ FLT4 P35916 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ GSK3A P49840 1/20 0.36
▸ MAPK10 P53779 1/20 0.36

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
SCHEMBL25913590 0.93 CSF1R (0.43) PDGFRBCSF1RPDGFRARIOK2BRAF
SCHEMBL25913006 0.90 CSF1R (0.40) PDGFRBCSF1RPDGFRARIOK2BRAF
SCHEMBL16049203 0.85 CSF1R (0.68) PDGFRBCSF1RPDGFRARIOK2BRAF
SCHEMBL25913001 0.84 BRAF (0.35) PDGFRBCSF1RPDGFRABRAFLCK
SCHEMBL25910298 0.81 CSF1R (0.75) PDGFRBCSF1RPDGFRARIOK2BRAF
SCHEMBL25909917 0.81 PDGFRB (0.52) PDGFRBCSF1RPDGFRABRAFMAPK14
SCHEMBL25911299 0.78 CSF1R (0.52) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25910421 0.78 PDGFRB (0.48) PDGFRBCSF1RPDGFRARIOK2BRAF
SCHEMBL25910422 0.78 PDGFRB (0.47) PDGFRBCSF1RPDGFRABRAFMAPK14
SCHEMBL25910419 0.78 PDGFRB (0.46) PDGFRBCSF1RPDGFRABRAFMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023125812-A1 SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2023-07-06 — — WO disclosed
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