SCHEMBL29904367

SCHEMBL29904367

CC(C)C[C@H](NC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 7/20 0.56
GNPAT O15228 1/20 0.54
SLC15A2 Q16348 1/20 0.54
OPRM1 P35372 1/20 0.53
NPY1R P25929 1/20 0.52
NPY2R P49146 1/20 0.52
NPY4R P50391 1/20 0.52
GHSR Q92847 1/20 0.51
MME P08473 1/20 0.51

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
SCHEMBL30434531 0.93 OPRK1 (0.56) OPRK1GNPATSLC15A2OPRM1
SCHEMBL29569557 0.93 OPRK1 (0.56) OPRK1GNPATSLC15A2OPRM1
SCHEMBL29389760 0.92 OPRK1 (0.57) OPRK1GNPATSLC15A2OPRM1
SCHEMBL1711945 0.91 SLC15A2 (0.62) GNPATSLC15A2GHSR
SCHEMBL1711937 0.91 SLC15A2 (0.62) GNPATSLC15A2GHSR
SCHEMBL29568812 0.90 OPRK1 (0.55) OPRK1GNPATOPRM1
SCHEMBL30957128 0.90 OPRK1 (0.68) OPRK1GNPATOPRM1NPY1RNPY2R
SCHEMBL29569125 0.89 OPRK1 (0.52) OPRK1OPRM1MME
SCHEMBL30292594 0.89 CTSB (0.53)
SCHEMBL30957130 0.88 OPRK1 (0.69) OPRK1GNPATOPRM1NPY1RNPY2R

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
WO-2022211624-A1 TAILOR-MADE FUNCTIONALIZED SELF-ASSEMBLED PEPTIDE (NANO)FIBERS AND HYDROGELS, AND METHODS, USES AND KITS RELATED THERETO RIJKSUNIVERSITEIT GRONINGEN (NL) 2022-10-06 WO disclosed