SCHEMBL31243878

SCHEMBL31243878

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

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 9/20 0.59
▸ OPRM1 P35372 8/20 0.59
▸ OPRK1 P41145 2/20 0.59
▸ OPRL1 P41146 2/20 0.58
▸ TFPI P10646 1/20 0.56
▸ NPBWR1 P48145 1/20 0.52

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
SCHEMBL30900788 0.98 OPRD1 (0.60) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL31243908 0.96 OPRD1 (0.55) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL31243859 0.93 OPRD1 (0.58) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL31243865 0.93 OPRD1 (0.58) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL31243860 0.93 KISS1R (0.52) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL31243925 0.93 TFPI (0.60) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL30900782 0.93 TFPI (0.65) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL30900790 0.93 TFPI (0.65) OPRD1OPRM1OPRK1OPRL1TFPI
SCHEMBL31243869 0.93 OPRD1 (0.69) OPRD1OPRM1OPRK1
SCHEMBL31243857 0.93 OPRD1 (0.67) 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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