SCHEMBL8311168

SCHEMBL8311168

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CC(N)c1ccccc12

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.53
TACR1 P25103 12/20 0.44
PPARA Q07869 1/20 0.42
KLK7 P49862 1/20 0.41
KLK5 Q9Y337 1/20 0.41
CTSS P25774 1/20 0.41
CYP3A4 P08684 1/20 0.40
UGCG Q16739 1/20 0.40

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
SCHEMBL8311164 1.00 GHSR (0.53) GHSRTACR1PPARAKLK7KLK5
SCHEMBL8314876 0.88 GHSR (0.49) GHSRTACR1PPARAKLK7KLK5
SCHEMBL8314871 0.88 GHSR (0.49) GHSRTACR1PPARAKLK7KLK5
SCHEMBL8315316 0.87 GHSR (0.51) GHSRTACR1
SCHEMBL8315320 0.87 GHSR (0.51) GHSRTACR1
SCHEMBL7572185 0.83 GHSR (0.52) GHSRTACR1PPARACTSSCYP3A4
SCHEMBL8311537 0.81 MEN1 (0.48) TACR1CTSSCYP3A4UGCG
SCHEMBL8311541 0.81 MEN1 (0.48) TACR1CTSSCYP3A4UGCG
SCHEMBL30661940 0.81 GHSR (0.78) GHSRTACR1
SCHEMBL7567562 0.81 GHSR (0.59) GHSRTACR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0662481-B1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO INC (US) 1999-03-24 EP disclosed
US-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 US disclosed
EP-0662481-A1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO. INC. (US) 1995-07-12 EP disclosed