SCHEMBL30979729

SCHEMBL30979729

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

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 4/20 0.60
▸ IL23R Q5VWK5 11/20 0.60
▸ UTS2R Q9UKP6 1/20 0.57
▸ KISS1R Q969F8 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 0.99 GHSR (0.60) GHSRIL23RUTS2RKISS1R
SCHEMBL29522651 0.99 GHSR (0.60) GHSRIL23RUTS2RKISS1R
SCHEMBL30276223 0.98 IL23R (0.59) GHSRIL23RUTS2RKISS1R
SCHEMBL29507073 0.97 GHSR (0.60) GHSRIL23RUTS2RKISS1R
SCHEMBL29366876 0.97 GHSR (0.60) GHSRIL23RUTS2RKISS1R
SCHEMBL30602952 0.97 GHSR (0.59) GHSRIL23RUTS2RKISS1R
SCHEMBL31514545 0.97 GHSR (0.59) GHSRIL23RUTS2RKISS1R
SCHEMBL30276245 0.96 IL23R (0.59) GHSRIL23RUTS2RKISS1R
SCHEMBL29938488 0.96 GHSR (0.59) GHSRIL23RUTS2RKISS1R
SCHEMBL29937863 0.96 GHSR (0.59) GHSRIL23RUTS2RKISS1R

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-118320057-A Exosome-loaded octreotide nanoparticle and preparation method thereof 中国人民解放军军事科学院防化研究院 2024-07-12 — — CN claimed
CN-118320057-A Exosome-loaded octreotide nanoparticle and preparation method thereof 中国人民解放军军事科学院防化研究院 2024-07-12 — — CN disclosed
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