SCHEMBL31257044

SCHEMBL31257044

CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 6/20 0.51
▸ OPRD1 P41143 8/20 0.50
▸ OPRM1 P35372 7/20 0.50
▸ OPRK1 P41145 1/20 0.50
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ NPY4R P50391 1/20 0.47

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
SCHEMBL29994088 0.89 OPRD1 (0.51) CCKBROPRD1OPRM1OPRK1
SCHEMBL31257035 0.88 OPRD1 (0.52) OPRD1OPRM1OPRK1NPY1RNPY2R
SCHEMBL31257056 0.88 OPRD1 (0.54) OPRD1OPRM1OPRK1NPY1RNPY2R
SCHEMBL29590483 0.88 OPRD1 (0.51) OPRD1OPRM1OPRK1NPY1RNPY2R
SCHEMBL29871876 0.88 OPRD1 (0.49) OPRD1OPRM1OPRK1
SCHEMBL31257049 0.88 NPY4R (0.59) OPRD1OPRM1OPRK1NPY1RNPY2R
SCHEMBL30495800 0.87 CCKBR (0.51) CCKBROPRD1OPRM1
SCHEMBL31257020 0.86 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL11512382 0.86 IL23R (0.51) CCKBROPRD1OPRM1OPRK1
SCHEMBL31256990 0.86 OPRD1 (0.55) OPRD1OPRM1OPRK1NPY1RNPY2R

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
US-20240352445-A1 HUMANIZATION, AFFINITY MATURATION, AND OPTIMIZATION METHODS FOR PROTEINS AND ANTIBODIES ABWIZ BIO, INC. 2024-10-24 — — US disclosed
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