SCHEMBL6833110

SCHEMBL6833110

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCN2C(O)C(C)(C)C(O)[C@]2(Cc2ccc(F)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.46
P2RX7 Q99572 1/20 0.41
PPARA Q07869 2/20 0.41
PABPC1 P11940 1/20 0.41
UGCG Q16739 5/20 0.39
CCKBR P32239 1/20 0.38
PPARG P37231 1/20 0.38
KLK7 P49862 2/20 0.38
KLK5 Q9Y337 2/20 0.38
CTSS P25774 1/20 0.38
CYP3A4 P08684 2/20 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
SCHEMBL5229912 0.82 GHSR (0.45) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL5229183 0.81 GHSR (0.45) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL6690540 0.81 GHSR (0.45) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL5254134 0.81 GHSR (0.73) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL5254137 0.81 GHSR (0.73) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL5254132 0.81 GHSR (0.73) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL6705735 0.79 GHSR (0.42) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL6691999 0.79 GHSR (0.42) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL6695743 0.78 GHSR (0.42) GHSRP2RX7PPARAPABPC1UGCG
SCHEMBL6691512 0.78 GHSR (0.42) GHSRP2RX7PPARAPABPC1UGCG

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
US-RE38524-E1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2004-06-01 US disclosed