SCHEMBL30276199

SCHEMBL30276199

C[C@@H](O)[C@H](NC(=O)[C@H](CCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 7/20 0.64
▸ KISS1R Q969F8 4/20 0.58
▸ NPY1R P25929 3/20 0.57
▸ NPY2R P49146 3/20 0.57
▸ NPY4R P50391 3/20 0.57
▸ GHSR Q92847 1/20 0.56
▸ IL1RN P18510 1/20 0.56
▸ ERAP2 Q6P179 1/20 0.56

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
SCHEMBL30276250 0.98 IL23R (0.65) IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL30276213 0.98 IL23R (0.65) IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL30276238 0.96 IL23R (0.59) IL23RKISS1RGHSR
SCHEMBL30276236 0.96 IL23R (0.59) IL23RKISS1RGHSR
SCHEMBL30276242 0.96 IL23R (0.63) IL23RKISS1R
SCHEMBL29408676 0.95 IL23R (0.65) IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL29361083 0.95 IL23R (0.65) IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL31514538 0.95 IL23R (0.65) IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL30380084 0.95 IL23R (0.65) IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL30276219 0.94 GHSR (0.61) IL23RGHSR

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
EP-3166967-B1 SYNTHETIC SOMATOSTATIN RECEPTOR LIGANDS TEL HASHOMER MEDICAL RES INFRASTRUCTURE & SERVICES LTD (IL) 2023-03-08 — — EP claimed
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