SCHEMBL31243949

SCHEMBL31243949

CC(C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 15/20 0.61
▸ OPRM1 P35372 12/20 0.61
▸ OPRK1 P41145 4/20 0.60

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
SCHEMBL31243914 0.97 OPRD1 (0.63) OPRD1OPRM1OPRK1
SCHEMBL31243940 0.95 OPRD1 (0.65) OPRD1OPRM1OPRK1
SCHEMBL31243862 0.94 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL31243874 0.94 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL31243876 0.93 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL30973964 0.92 OPRD1 (0.54) OPRD1OPRM1OPRK1
SCHEMBL31243881 0.92 OPRD1 (0.60) OPRD1OPRM1OPRK1
SCHEMBL31243930 0.92 OPRD1 (0.65) OPRD1OPRM1OPRK1
SCHEMBL31243890 0.91 OPRM1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL31243888 0.91 OPRD1 (0.64) OPRD1OPRM1OPRK1

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
CN-120202191-A Inhibitors of prostate specific membrane antigen and uses thereof 上海先通生物科技有限公司 2025-06-24 — — CN disclosed
CN-119072472-A FAP inhibitors 上海先通生物科技有限公司 2024-12-03 — — CN disclosed
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