SCHEMBL30953402

SCHEMBL30953402

CC1CCC([C@H](NC(=O)OC(C)(C)C)C(=O)Nc2cc(Br)ccn2)CC1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 11/20 0.60
▸ GSK3B P49841 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37
▸ FPR2 P25090 3/20 0.37
▸ MMP1 P03956 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ EGFR P00533 2/20 0.35
▸ CTSB P07858 1/20 0.35
▸ CTSS P25774 1/20 0.35
▸ CTSK P43235 1/20 0.35

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
SCHEMBL30953440 0.89 AAK1 (0.51) AAK1MMP1LMNARAB9A
SCHEMBL30953339 0.87 AAK1 (0.50) AAK1CDK5DYRK1ACDK5R1MMP1
SCHEMBL30953319 0.87 AAK1 (0.55) AAK1GSK3BCDK5DYRK1ACDK5R1
SCHEMBL30953221 0.86 AAK1 (0.48) AAK1CDK5DYRK1ACDK5R1MMP1
SCHEMBL30953269 0.86 AAK1 (0.48) AAK1GSK3BMMP1LMNARAB9A
SCHEMBL27393615 0.86 AAK1 (0.48) AAK1CDK5DYRK1ACDK5R1MMP1
SCHEMBL27393638 0.86 AAK1 (0.48) AAK1GSK3BMMP1LMNARAB9A
SCHEMBL30953274 0.85 AAK1 (0.48) AAK1GSK3BMMP1LMNARAB9A
SCHEMBL24103850 0.85 AAK1 (0.58) AAK1CDK5CDK5R1FPR2LMNA
SCHEMBL30282565 0.85 AAK1 (0.58) AAK1CDK5CDK5R1FPR2LMNA

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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