SCHEMBL6691999

SCHEMBL6691999

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

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.42
P2RX7 Q99572 3/20 0.39
PPARA Q07869 2/20 0.39
UGCG Q16739 5/20 0.38
CCKBR P32239 1/20 0.37
PPARG P37231 1/20 0.36
TACR1 P25103 1/20 0.36
CTSS P25774 1/20 0.36
CYP3A4 P08684 2/20 0.36
PABPC1 P11940 1/20 0.35
RAB9A P51151 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
SCHEMBL6695783 0.89 GHSR (0.53) GHSRP2RX7UGCGCCKBRCYP3A4
SCHEMBL6693779 0.89 GHSR (0.53) GHSRP2RX7UGCGCCKBRCYP3A4
SCHEMBL6689707 0.89 GHSR (0.53) GHSRP2RX7UGCGCCKBRCYP3A4
SCHEMBL5229183 0.87 GHSR (0.45) GHSRP2RX7PPARAUGCGCCKBR
SCHEMBL5229912 0.86 GHSR (0.45) GHSRP2RX7PPARAUGCGCCKBR
SCHEMBL6705735 0.84 GHSR (0.42) GHSRP2RX7PPARAUGCGCCKBR
SCHEMBL6690540 0.84 GHSR (0.45) GHSRP2RX7PPARAUGCGCCKBR
SCHEMBL6695743 0.84 GHSR (0.42) GHSRP2RX7PPARAUGCGCCKBR
SCHEMBL6691512 0.84 GHSR (0.42) GHSRP2RX7PPARAUGCGCCKBR
SCHEMBL6689702 0.83 GHSR (0.40) GHSRUGCGCCKBRTACR1CYP3A4

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