SCHEMBL30276245

SCHEMBL30276245

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

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 7/20 0.59
▸ GHSR Q92847 2/20 0.57
▸ KISS1R Q969F8 2/20 0.55
▸ UTS2R Q9UKP6 1/20 0.54
▸ ACE P12821 1/20 0.54

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
SCHEMBL30276259 0.98 GHSR (0.60) IL23RGHSRKISS1RUTS2R
SCHEMBL30276223 0.97 IL23R (0.59) IL23RGHSRKISS1RUTS2R
SCHEMBL30276242 0.96 IL23R (0.63) IL23RKISS1R
SCHEMBL29522651 0.96 GHSR (0.60) IL23RGHSRKISS1RUTS2R
SCHEMBL30979729 0.96 GHSR (0.60) IL23RGHSRKISS1RUTS2R
SCHEMBL30276238 0.95 IL23R (0.59) IL23RGHSRKISS1RUTS2RACE
SCHEMBL30276236 0.95 IL23R (0.59) IL23RGHSRKISS1RUTS2RACE
SCHEMBL29507073 0.95 GHSR (0.60) IL23RGHSRKISS1RUTS2R
SCHEMBL29366876 0.95 GHSR (0.60) IL23RGHSRKISS1RUTS2R
SCHEMBL31514545 0.95 GHSR (0.59) IL23RGHSRKISS1RUTS2R

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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