SCHEMBL30512524

SCHEMBL30512524

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 16/20 0.67
▸ NPBWR1 P48145 2/20 0.66
▸ GHSR Q92847 2/20 0.63
▸ NPY2R P49146 1/20 0.63

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
SCHEMBL29641064 0.92 NPBWR1 (0.66) IL23RNPBWR1GHSRNPY2R
SCHEMBL29883780 0.91 NPBWR1 (0.62) IL23RNPBWR1GHSRNPY2R
SCHEMBL29461984 0.91 NPBWR1 (0.62) IL23RNPBWR1GHSRNPY2R
SCHEMBL31696777 0.91 IL23R (0.66) IL23RNPBWR1
SCHEMBL30596141 0.91 IL23R (0.69) IL23RNPBWR1
SCHEMBL31141444 0.90 NPBWR1 (0.70) IL23RNPBWR1GHSRNPY2R
SCHEMBL30824297 0.90 IL23R (0.69) IL23RGHSRNPY2R
SCHEMBL30097937 0.89 IL23R (0.63) IL23RGHSRNPY2R
SCHEMBL30518169 0.88 NPBWR1 (0.62) IL23RNPBWR1
SCHEMBL38650746 0.88 GLP1R (0.65) IL23RNPBWR1

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
CN-116490215-A Targeted mediated endocytic drug delivery CRM医疗有限公司 2023-07-25 — — CN disclosed
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