SCHEMBL31643053

SCHEMBL31643053

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 1/20 0.46
▸ OPRM1 P35372 3/20 0.45
▸ OPRD1 P41143 3/20 0.45
▸ BACE1 P56817 2/20 0.44
▸ MME P08473 4/20 0.44
▸ FNTA P49354 1/20 0.43
▸ FNTB P49356 1/20 0.43
▸ CTSD P07339 1/20 0.41

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
SCHEMBL29822509 0.90 OPRM1 (0.51) CTSBOPRM1OPRD1BACE1MME
SCHEMBL29702429 0.89 MME (0.50) BACE1MMEFNTAFNTBCTSD
SCHEMBL31462059 0.87 OPRM1 (0.45) CTSBOPRM1OPRD1
SCHEMBL29886805 0.85 CTSB (0.48) CTSBOPRM1OPRD1BACE1MME
SCHEMBL30950645 0.85 OPRM1 (0.45) CTSBOPRM1OPRD1BACE1
SCHEMBL30950658 0.85 OPRM1 (0.45) CTSBOPRM1OPRD1BACE1
SCHEMBL30690380 0.85 CTSB (0.47) CTSBOPRM1OPRD1BACE1
SCHEMBL30690370 0.84 CTSB (0.46) CTSBOPRM1OPRD1BACE1CTSD
SCHEMBL31021037 0.84 OPRM1 (0.41) CTSBOPRM1OPRD1MMECTSD
SCHEMBL30454924 0.84 MME (0.47) BACE1MMEFNTAFNTBCTSD

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
WO-2025137591-A1 COMPOSITIONS, METHODS, AND SYSTEMS FOR PROMOTING ZINC SOLUBILIZATION AND ZINC UPTAKE IN PLANTS Tenfold Technologies, LLC (US) 2025-06-26 — — WO claimed
WO-2025137591-A1 COMPOSITIONS, METHODS, AND SYSTEMS FOR PROMOTING ZINC SOLUBILIZATION AND ZINC UPTAKE IN PLANTS Tenfold Technologies, LLC (US) 2025-06-26 — — WO disclosed
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