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SCHEMBL31351849

SCHEMBL31351849

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NMUR2 Q9GZQ4 6/20 0.59
▸ NMUR1 Q9HB89 6/20 0.59
▸ OPRD1 P41143 5/20 0.54
▸ OPRM1 P35372 2/20 0.54
▸ NPY4R P50391 6/20 0.52
▸ NPY1R P25929 5/20 0.52
▸ NPY2R P49146 5/20 0.52
▸ NPY5R Q15761 5/20 0.52
▸ NTSR1 P30989 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
SCHEMBL11884805 0.93 NMUR2 (0.61) NMUR2NMUR1OPRD1OPRM1NPY4R
SCHEMBL11884818 0.93 NMUR2 (0.61) NMUR2NMUR1OPRD1OPRM1NPY4R
SCHEMBL5499951 0.89 NPY4R (0.58) NMUR2NMUR1NPY4RNPY1RNPY2R
Hydrochloric Acid SCHEMBL11644061 0.89 OPRK1 (0.56) NMUR2NMUR1OPRM1
SCHEMBL30259519 0.87 NMUR2 (0.57) NMUR2NMUR1OPRM1NPY4RNPY1R
SCHEMBL30064735 0.87 NPY4R (0.58) NMUR2NMUR1OPRM1NPY4RNPY1R
SCHEMBL10588690 0.86 NPY4R (0.61) NMUR2NMUR1NPY4RNPY1RNPY2R
SCHEMBL5167437 0.86 KISS1R (0.67) —
SCHEMBL5167427 0.86 KISS1R (0.67) —
SCHEMBL29619531 0.85 NPY4R (0.58) NMUR2NMUR1OPRM1NPY4RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025010482-A1 MODIFIED GNRH PEPTIDE AND ITS CONJUGATE FOR MAMMALIAN IMMUNOCASTRATION, MANUFACTURING METHOD, COMPOSITION AND KIT OURO FINO SAÚDE ANIMAL LTDA (BR) 2025-01-16 — — WO disclosed
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