SCHEMBL30287670

SCHEMBL30287670

N#Cc1ccc2nccc(Nc3cccc(-c4nc5ccc(Nc6ccncc6)cc5[nH]4)c3)c2c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 14/20 0.58
▸ PKN1 Q16512 1/20 0.51
▸ PKN2 Q16513 1/20 0.51
▸ MAPKAPK2 P49137 2/20 0.47
▸ CSNK1A1 P48729 1/20 0.45
▸ CSNK1D P48730 1/20 0.45
▸ GSK3B P49841 1/20 0.45
▸ CSNK1G2 P78368 1/20 0.45
▸ RAF1 P04049 1/20 0.44
▸ BRAF P15056 1/20 0.44
▸ LRRK2 Q5S007 1/20 0.44

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
SCHEMBL24006108 1.00 KDR (0.58) KDRPKN1PKN2MAPKAPK2CSNK1A1
SCHEMBL24003905 1.00 KDR (0.58) KDRPKN1PKN2MAPKAPK2CSNK1A1
SCHEMBL23999436 0.93 KDR (0.59) KDRPKN1PKN2MAPKAPK2CSNK1A1
SCHEMBL23999350 0.93 KDR (0.59) KDRPKN1PKN2MAPKAPK2CSNK1A1
SCHEMBL24006229 0.90 KDR (0.52) KDRPKN1PKN2MAPKAPK2CSNK1A1
SCHEMBL24006251 0.90 KDR (0.46) KDRPKN1PKN2MAPKAPK2GSK3B
SCHEMBL24006095 0.87 MAPKAPK2 (0.44) KDRPKN1PKN2MAPKAPK2GSK3B
SCHEMBL30287671 0.87 MAPKAPK2 (0.44) KDRPKN1PKN2MAPKAPK2GSK3B
SCHEMBL24003904 0.86 KDR (0.71) KDR
SCHEMBL23999449 0.86 MAPKAPK2 (0.52) KDRPKN1PKN2MAPKAPK2RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4426289-A1 AKT3 MODULATORS Georgiamune Inc. (US) 2024-09-11 — — EP disclosed
CN-118574610-A AKT3 modulators 乔治穆内公司 2024-08-30 — — CN disclosed
WO-2023081845-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 — — WO disclosed
CN-115996721-A AKT3 modulators 乔治穆内有限责任公司 2023-04-21 — — CN disclosed
CN-115867266-A AKT3 modulators 乔治穆内有限责任公司 2023-03-28 — — CN disclosed
EP-4146212-A1 AKT3 MODULATORS Georgiamune LLC (US) 2023-03-15 — — EP disclosed
EP-4146185-A1 AKT3 MODULATORS Georgiamune LLC (US) 2023-03-15 — — EP disclosed
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