SCHEMBL38660704

SCHEMBL38660704

C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 6/20 0.58
▸ NPY4R P50391 6/20 0.58
▸ NPY1R P25929 5/20 0.58
▸ OPRD1 P41143 11/20 0.57
▸ CCKBR P32239 5/20 0.57
▸ CCKAR P32238 4/20 0.57
▸ NPY2R P49146 3/20 0.54
▸ OPRM1 P35372 4/20 0.53
▸ OPRK1 P41145 1/20 0.53
▸ TFPI P10646 1/20 0.53

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
SCHEMBL29518715 0.97 NPY4R (0.56) NPY5RNPY4RNPY1ROPRD1CCKBR
SCHEMBL29960067 0.95 NPY4R (0.62) NPY5RNPY4RNPY1RNPY2RTFPI
SCHEMBL29679886 0.91 NPY5R (0.56) NPY5RNPY4RNPY1ROPRD1CCKBR
SCHEMBL29596291 0.91 TFPI (0.66) TFPI
SCHEMBL29375862 0.90 NPY4R (0.62) NPY5RNPY4RNPY1ROPRD1NPY2R
SCHEMBL30956315 0.90 NPY4R (0.51) NPY5RNPY4RNPY1RNPY2R
SCHEMBL30844091 0.90 NPY4R (0.63) NPY5RNPY4RNPY1ROPRD1CCKBR
SCHEMBL29374790 0.89 NPY4R (0.58) NPY5RNPY4RNPY1ROPRD1CCKBR
SCHEMBL30844088 0.88 OPRD1 (0.62) OPRD1CCKBRCCKAROPRM1OPRK1
SCHEMBL31458901 0.88 NPY4R (0.53) NPY5RNPY4RNPY1ROPRD1CCKBR

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-120943953-B Monoclonal antibody specifically binding to EsxA and therapeutic reagent thereof 西京学院 2026-05-15 — — CN claimed
CN-120943953-B Monoclonal antibody specifically binding to EsxA and therapeutic reagent thereof 西京学院 2026-05-15 — — CN disclosed
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