SCHEMBL31243925

SCHEMBL31243925

CC(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 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.60
▸ OPRD1 P41143 8/20 0.55
▸ OPRM1 P35372 7/20 0.55
▸ OPRK1 P41145 2/20 0.55
▸ OPRL1 P41146 2/20 0.54
▸ IL23R Q5VWK5 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
SCHEMBL31243855 0.97 OPRD1 (0.59) TFPIOPRD1OPRM1OPRK1OPRL1
SCHEMBL31243908 0.94 OPRD1 (0.55) TFPIOPRD1OPRM1OPRK1OPRL1
SCHEMBL31243890 0.94 OPRM1 (0.57) TFPIOPRD1OPRM1OPRK1OPRL1
SCHEMBL31243858 0.94 TFPI (0.55) TFPIOPRD1OPRM1OPRK1IL23R
SCHEMBL31243861 0.93 OPRD1 (0.62) TFPIOPRD1OPRM1OPRK1
SCHEMBL31243878 0.93 OPRD1 (0.59) TFPIOPRD1OPRM1OPRK1OPRL1
SCHEMBL31243945 0.93 OPRD1 (0.56) TFPIOPRD1OPRM1OPRK1IL23R
SCHEMBL31243862 0.92 OPRD1 (0.58) TFPIOPRD1OPRM1OPRK1OPRL1
SCHEMBL31243865 0.92 OPRD1 (0.58) TFPIOPRD1OPRM1OPRK1OPRL1
SCHEMBL31243859 0.92 OPRD1 (0.58) TFPIOPRD1OPRM1OPRK1OPRL1

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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