SCHEMBL29630592

SCHEMBL29630592

N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 2/20 0.46
▸ OPRM1 P35372 3/20 0.46
▸ OPRD1 P41143 1/20 0.42
▸ OPRK1 P41145 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
SCHEMBL29591738 1.00 TRHR (0.46) TRHROPRM1OPRD1OPRK1
SCHEMBL4595206 0.91 DPP4 (0.44) —
SCHEMBL4595209 0.91 DPP4 (0.44) —
SCHEMBL5734357 0.91 DPP4 (0.44) —
SCHEMBL31040597 0.90 OPRM1 (0.52) OPRM1OPRD1OPRK1
SCHEMBL30274845 0.90 TRHR (0.46) TRHR
SCHEMBL29776002 0.89 OPRM1 (0.51) TRHROPRM1OPRD1OPRK1
SCHEMBL29630670 0.89 TRHR (0.42) TRHROPRK1
SCHEMBL31072130 0.87 REN (0.46) TRHROPRM1
SCHEMBL7759091 0.87 DPP4 (0.42) —

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 — — US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 — — US disclosed
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