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SCHEMBL30717848

SCHEMBL30717848

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

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.44
▸ OPRD1 P41143 2/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ KISS1R Q969F8 3/20 0.44
▸ OPRL1 P41146 5/20 0.44
▸ F2 P00734 1/20 0.43
▸ BACE1 P56817 1/20 0.42
▸ BACE2 Q9Y5Z0 1/20 0.42

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
SCHEMBL30717897 1.00 OPRM1 (0.44) OPRM1OPRD1OPRK1KISS1ROPRL1
SCHEMBL30717879 0.97 F2 (0.45) OPRM1OPRD1F2BACE1BACE2
SCHEMBL30717885 0.97 F2 (0.45) OPRM1OPRD1F2BACE1BACE2
SCHEMBL30717877 0.97 F2 (0.45) OPRM1OPRD1F2BACE1BACE2
SCHEMBL30717867 0.95 TFPI (0.46) F2BACE1BACE2
SCHEMBL30717846 0.94 GNPAT (0.46) OPRM1OPRD1OPRK1
SCHEMBL30717849 0.94 OPRD1 (0.52) OPRM1OPRD1OPRK1OPRL1
SCHEMBL30717911 0.93 KISS1R (0.47) OPRM1OPRD1OPRK1KISS1ROPRL1
SCHEMBL30717882 0.92 IL23R (0.49) KISS1RF2BACE1BACE2
SCHEMBL30717856 0.92 IL23R (0.49) KISS1RF2BACE1BACE2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4590664-A1 INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN AND USE THEREOF Shanghai Sinotau Biotech. Co., Ltd (CN) 2025-07-30 — — EP disclosed
WO-2025055942-A1 INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN AND USE THEREOF SHANGHAI SINOTAU BIOTECH. CO., LTD (CN) 2025-03-20 — — WO disclosed
WO-2025055943-A1 INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN AND USE THEREOF SHANGHAI SINOTAU BIOTECH. CO., LTD (CN) 2025-03-20 — — WO disclosed
EP-4511367-A1 FAP INHIBITORS Shanghai Sinotau Biotech. Co., Ltd (CN) 2025-02-26 — — EP disclosed
WO-2024022332-A1 FAP INHIBITORS SHANGHAI SINOTAU BIOTECH. CO., LTD (CN) 2024-02-01 — — WO disclosed
WO-2023202655-A1 FAP INHIBITORS SHANGHAI SINOTAU BIOTECH. CO., LTD (CN) 2023-10-26 — — WO disclosed
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