SCHEMBL30953342

SCHEMBL30953342

CC(C)(C)OC(=O)N[C@H](C(=O)Nc1cc(CNC[C@H](N)C(F)(F)F)ccn1)C(C1CC1)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 3/20 0.38
▸ ATM Q13315 2/20 0.36
▸ IGF1R P08069 1/20 0.36
▸ NR3C2 P08235 3/20 0.35
▸ CCR2 P41597 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ACACB O00763 1/20 0.33
▸ ACACA Q13085 1/20 0.33
▸ CA2 P00918 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ CDK5 Q00535 1/20 0.32
▸ DYRK1A Q13627 1/20 0.32
▸ CDK5R1 Q15078 1/20 0.32

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
Trifluoroacetic Acid SCHEMBL30953400 0.97 ATM (0.37) AAK1ATMIGF1RNR3C2CCR2
SCHEMBL30953509 0.87 NR3C2 (0.34) NR3C2CYP3A4
SCHEMBL27393526 0.87 AAK1 (0.43) AAK1ATMIGF1RNR3C2CCR2
SCHEMBL30953454 0.87 AAK1 (0.43) AAK1ATMIGF1RNR3C2CCR2
SCHEMBL30953527 0.84 IGF1R (0.46) AAK1ATMIGF1RNR3C2CCR2
SCHEMBL30953409 0.83 CYP3A4 (0.40) AAK1ATMIGF1RNR3C2CYP3A4
SCHEMBL30953405 0.83 CYP3A4 (0.40) AAK1ATMIGF1RNR3C2CYP3A4
SCHEMBL30953236 0.83 CDK5 (0.40) AAK1ATMIGF1RNR3C2CCR2
Trifluoroacetic Acid SCHEMBL30953408 0.82 AAK1 (0.39) AAK1ATMIGF1RNR3C2CCR2
SCHEMBL30953392 0.79 CCNE1 (0.41) AAK1ATMIGF1RNR3C2CYP3A4

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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