SCHEMBL29519677

SCHEMBL29519677

CSCCC(NC(=O)C(CO)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(N)CO)C(=O)NC(CCC(=O)O)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCN=C(N)N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 2/20 0.57
▸ NPY1R P25929 3/20 0.56
▸ NPY2R P49146 3/20 0.56
▸ NPY4R P50391 3/20 0.56
▸ CCKBR P32239 6/20 0.54
▸ PTGS1 P23219 1/20 0.54
▸ PTH1R Q03431 1/20 0.54
▸ MC4R P32245 1/20 0.54
▸ MC5R P33032 1/20 0.54
▸ MC3R P41968 1/20 0.54
▸ MC1R Q01726 1/20 0.54
▸ GNRHR P30968 2/20 0.54
▸ ABCC2 Q92887 1/20 0.53
▸ NPBWR1 P48145 1/20 0.53

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
SCHEMBL29519296 0.92 KISS1R (0.60) KISS1RNPY1RNPY2RNPY4RCCKBR
SCHEMBL30366588 0.92 KISS1R (0.60) KISS1RNPY1RNPY2RNPY4RCCKBR
SCHEMBL30494060 0.90 KISS1R (0.60) KISS1RNPY1RNPY2RNPY4RCCKBR
SCHEMBL30618455 0.87 NPY1R (0.57) KISS1RNPY1RNPY2RNPY4RCCKBR
SCHEMBL29849030 0.87 NPY1R (0.57) KISS1RNPY1RNPY2RNPY4RCCKBR
SCHEMBL29973199 0.82 CTSL (0.54) KISS1RCCKBRPTH1RMC4RMC5R
SCHEMBL29399016 0.80 GHSR (0.68) KISS1RNPY1RNPY2RNPY4R
SCHEMBL16455227 0.80 CTSL (0.55) KISS1RCCKBRPTH1RMC4RMC5R
SCHEMBL29402231 0.80 GHSR (0.69) KISS1RNPY1RNPY2RNPY4R
SCHEMBL29357687 0.79 KISS1R (0.62) KISS1RMC4RMC5RMC3RMC1R

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
US-11821902-B2 Quantitative peptide or protein assay PIERCE BIOTECHNOLOGY, INC. (US) 2023-11-21 — — US disclosed
EP-3973978-A1 METHODS OF MODULATING CORTICOSTEROID RESPONSE Mallinckrodt Ard IP Unlimited Company (IE) 2022-03-30 — — EP disclosed
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