SCHEMBL30558306

SCHEMBL30558306

CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 14/20 0.65
▸ KISS1R Q969F8 5/20 0.62
▸ NPBWR1 P48145 1/20 0.57

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
SCHEMBL29973185 0.94 KISS1R (0.60) IL23RKISS1RNPBWR1
SCHEMBL30518175 0.93 IL23R (0.67) IL23RNPBWR1
Ser-100 SCHEMBL27712482 0.92 IL23R (0.65) IL23RKISS1RNPBWR1
SCHEMBL13097862 0.92 IL23R (0.65) IL23RKISS1RNPBWR1
SCHEMBL30845361 0.92 KISS1R (0.70) KISS1R
SCHEMBL30845365 0.92 KISS1R (0.70) KISS1R
SCHEMBL30518037 0.91 IL23R (0.67) IL23RNPBWR1
SCHEMBL13204216 0.91 IL23R (0.60) IL23RKISS1RNPBWR1
SCHEMBL27712474 0.90 NPY1R (0.60) IL23RKISS1RNPBWR1
SCHEMBL30340502 0.90 IL23R (0.75) IL23RKISS1R

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-116813693-B Label compound for polypeptide synthesis and application of label compound in polypeptide synthesis 苏州金顶生物有限公司 2023-12-01 — — CN disclosed
CN-116813693-A Label compound for polypeptide synthesis and application of label compound in polypeptide synthesis 苏州金顶生物有限公司 2023-09-29 — — CN disclosed
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