SCHEMBL30495592

SCHEMBL30495592

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

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ UTS2R Q9UKP6 1/20 0.58
▸ GHSR Q92847 2/20 0.56
▸ NPY1R P25929 3/20 0.56
▸ NPY2R P49146 3/20 0.56
▸ NPY4R P50391 3/20 0.56
▸ KISS1R Q969F8 9/20 0.56
▸ CCKAR P32238 1/20 0.55
▸ CCKBR P32239 1/20 0.55
▸ OPRD1 P41143 1/20 0.55
▸ IL23R Q5VWK5 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
SCHEMBL30539457 0.90 GHSR (0.59) UTS2RGHSRCCKARCCKBROPRD1
SCHEMBL30539459 0.90 GHSR (0.59) UTS2RGHSRCCKARCCKBROPRD1
SCHEMBL31731732 0.90 GHSR (0.62) UTS2RGHSRNPY1RNPY2RNPY4R
SCHEMBL30518046 0.90 GHSR (0.60) UTS2RGHSRNPY1RNPY2RNPY4R
SCHEMBL29508714 0.90 GHSR (0.64) UTS2RGHSRNPY1RNPY2RNPY4R
SCHEMBL29508662 0.90 GHSR (0.63) GHSRNPY1RNPY2RNPY4ROPRD1
SCHEMBL25118466 0.89 UTS2R (0.58) UTS2RGHSRNPY1RNPY2RNPY4R
SCHEMBL21896530 0.89 UTS2R (0.58) UTS2RGHSRNPY1RNPY2RNPY4R
SCHEMBL31607205 0.89 GHSR (0.62) UTS2RGHSR
SCHEMBL30365508 0.89 OPRD1 (0.62) CCKARCCKBROPRD1

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
US-20230190887-A1 TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION UNIVERSITY OF SOUTH CAROLINA (US) 2023-06-22 — — US disclosed
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