SCHEMBL6695783

SCHEMBL6695783

COC1=C(C)C(=O)N2CCN(C(=O)[C@@H](COCc3ccccc3)NC(=O)C(C)(C)N)C[C@@]12Cc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 10/20 0.53
UGCG Q16739 6/20 0.40
CCKBR P32239 1/20 0.39
CYP3A4 P08684 2/20 0.37
P2RX7 Q99572 1/20 0.36

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
SCHEMBL6689707 1.00 GHSR (0.53) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL6693779 1.00 GHSR (0.53) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL6691999 0.89 GHSR (0.42) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL6689702 0.88 GHSR (0.40) GHSRUGCGCCKBRCYP3A4
SCHEMBL6691543 0.86 GHSR (0.54) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL6691541 0.86 GHSR (0.54) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL5227924 0.86 GHSR (0.57) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL5232861 0.86 GHSR (0.57) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL5228854 0.86 GHSR (0.57) GHSRUGCGCCKBRCYP3A4P2RX7
SCHEMBL5226014 0.85 GHSR (0.57) GHSRUGCGCCKBRCYP3A4P2RX7

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-1002802-B1 Dipeptide derivatives as growth hormone secretagogues PFIZER PROD INC (US) 2004-12-08 EP disclosed
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