SCHEMBL7899507

SCHEMBL7899507

COC1=CC(=O)N2CCN(C(=O)[C@@H](COCc3ccccc3)NC(=O)C(C)(C)NC(=O)OC(C)(C)C)CC12Cc1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.42
UGCG Q16739 11/20 0.38
PPARA Q07869 1/20 0.37
CYP3A4 P08684 1/20 0.36
CTSS P25774 1/20 0.36
KLK7 P49862 1/20 0.35
KLK5 Q9Y337 1/20 0.35

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
SCHEMBL7899504 1.00 GHSR (0.42) GHSRUGCGPPARACYP3A4CTSS
SCHEMBL6695238 0.89 GHSR (0.53) GHSRUGCG
SCHEMBL6694201 0.89 GHSR (0.53) GHSRUGCG
SCHEMBL6694204 0.89 GHSR (0.53) GHSRUGCG
SCHEMBL5228589 0.84 GHSR (0.45) GHSRUGCGPPARACYP3A4CTSS
SCHEMBL5230927 0.84 GHSR (0.45) GHSRUGCGPPARACYP3A4CTSS
SCHEMBL5224140 0.84 GHSR (0.44) GHSRUGCGPPARACYP3A4CTSS
SCHEMBL5231715 0.84 GHSR (0.45) GHSRUGCGPPARACYP3A4CTSS
SCHEMBL7903082 0.80 GHSR (0.47) GHSRUGCGPPARACYP3A4CTSS
SCHEMBL5251052 0.79 GHSR (0.68) GHSRUGCGPPARACYP3A4CTSS

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-6194578-B1 GROWTH HORMONE SECRETAGOGUES; USEFUL FOR PROPHYLAXIS AND THERAPY OF OSTEOPOROSIS AND/OR FRAILTY, INSULIN RESISTANCE IN MAMMALS, CONGESTIVE HEART FAILURE, OBESITY, ACCELERATING BONE FRACTURE REPAIR REDUCING CACHEXIA AND PROTEIN LOSS PFIZER INC. 2001-02-27 US disclosed
EP-1002802-A1 Dipeptide derivatives as growth hormone secretagogues Pfizer Products Inc. (US) 2000-05-24 EP disclosed