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Sugi Predict / Compounds / SCHEMBL31243857

SCHEMBL31243857

SCHEMBL31243857

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

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 18/20 0.67
▸ OPRM1 P35372 9/20 0.67
▸ OPRK1 P41145 2/20 0.67
▸ CCKAR P32238 3/20 0.56
▸ CCKBR P32239 3/20 0.56

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
SCHEMBL31243869 0.98 OPRD1 (0.69) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL30900788 0.95 OPRD1 (0.60) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL31257081 0.94 OPRD1 (0.64) OPRD1OPRM1OPRK1
SCHEMBL31243902 0.93 OPRD1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL31243856 0.93 OPRD1 (0.70) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL31243878 0.93 OPRD1 (0.59) OPRD1OPRM1OPRK1
SCHEMBL31243872 0.92 OPRD1 (0.64) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL31243940 0.91 OPRD1 (0.65) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL31243865 0.90 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL31243873 0.90 OPRD1 (0.63) OPRD1OPRM1OPRK1CCKARCCKBR

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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