SCHEMBL30953508

SCHEMBL30953508

COCC(=O)c1ccnc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCC(F)(F)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 4/20 0.42
▸ GSK3B P49841 12/20 0.36
▸ MAPT P10636 10/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ GSK3A P49840 2/20 0.33
▸ ACACB O00763 1/20 0.33
▸ ACACA Q13085 1/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33
▸ PSENEN Q9NZ42 1/20 0.33

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
SCHEMBL30953416 0.90 AAK1 (0.42) AAK1GSK3BMAPTMAPK1GSK3A
SCHEMBL30953237 0.89 AAK1 (0.46) AAK1GSK3BMAPTHIF1AGSK3A
SCHEMBL30953417 0.87 AAK1 (0.44) AAK1GSK3BMAPTGSK3A
SCHEMBL30953223 0.87 AAK1 (0.44) AAK1GSK3BMAPTMAPK1GSK3A
SCHEMBL30953439 0.84 AAK1 (0.44) AAK1MAPK1
SCHEMBL30953210 0.84 AAK1 (0.46) AAK1MAPK1
SCHEMBL30953319 0.84 AAK1 (0.55) AAK1GSK3BMAPTMAPK1
SCHEMBL31581652 0.84 AAK1 (0.47) AAK1MAPTHIF1A
SCHEMBL30953311 0.82 AAK1 (0.44) AAK1GSK3BMAPTMAPK1
SCHEMBL30953388 0.82 AAK1 (0.46) AAK1GSK3BMAPTMAPK1

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
EP-4630115-A1 THERAPEUTIC COMPOUNDS Sanofi (FR) 2025-10-15 — — EP disclosed
WO-2024121427-A1 THERAPEUTIC COMPOUNDS SANOFI (FR) 2024-06-13 — — WO disclosed
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