SCHEMBL25496209

SCHEMBL25496209

COC(=O)[C@H](CC(C)C)NC(=O)c1ccc(C)cc1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 17/20 0.74
▸ TAS1R1 Q7RTX1 17/20 0.74
▸ CTSS P25774 1/20 0.57
▸ CTSK P43235 1/20 0.57
▸ BCL2L1 Q07817 2/20 0.53

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
SCHEMBL4197744 1.00 TAS1R3 (0.74) TAS1R3TAS1R1CTSSCTSKBCL2L1
SCHEMBL4197741 1.00 TAS1R3 (0.74) TAS1R3TAS1R1CTSSCTSKBCL2L1
SCHEMBL25496208 0.90 TAS1R3 (0.61) TAS1R3TAS1R1CTSSCTSK
SCHEMBL7513867 0.88 TAS1R3 (0.71) TAS1R3TAS1R1BCL2L1
SCHEMBL26814846 0.87 TAS1R3 (0.69) TAS1R3TAS1R1CTSSCTSKBCL2L1
SCHEMBL6241209 0.86 TAS1R3 (0.68) TAS1R3TAS1R1CTSSCTSK
SCHEMBL10407750 0.86 TAS1R3 (0.68) TAS1R3TAS1R1CTSSCTSK
SCHEMBL4195344 0.85 TAS1R3 (1.00) TAS1R3TAS1R1
SCHEMBL4195341 0.85 TAS1R3 (1.00) TAS1R3TAS1R1
SCHEMBL4160513 0.84 CA2 (0.68) TAS1R3TAS1R1CTSSCTSK

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
US-20250024871-A1 AMIDE COMPOUNDS AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH INCORPORATED (US) 2025-01-23 — — US disclosed
WO-2023091315-A2 AMIDE COMPOUNDS AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH INCORPORATED (US) 2023-05-25 — — WO disclosed
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