SCHEMBL6312458

SCHEMBL6312458

CN1C[C@@H]2CCN(C(=O)[C@@H](COCc3ccccc3)NC(=O)C(C)(C)NC(=O)OC(C)(C)C)C[C@@]2(Cc2ccccc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.49
PPARA Q07869 2/20 0.41
CTSS P25774 1/20 0.40
PPARG P37231 1/20 0.38
KLK7 P49862 2/20 0.38
KLK5 Q9Y337 2/20 0.38
KMT2A Q03164 2/20 0.38
CCKBR P32239 2/20 0.38
MAPK1 P28482 1/20 0.38
CYP3A4 P08684 1/20 0.37
UGCG Q16739 1/20 0.37

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
SCHEMBL5226623 1.00 GHSR (0.49) GHSRPPARACTSSPPARGKLK7
SCHEMBL5226618 1.00 GHSR (0.49) GHSRPPARACTSSPPARGKLK7
SCHEMBL5228207 0.88 GHSR (0.63) GHSRCCKBR
SCHEMBL5229351 0.88 GHSR (0.63) GHSRCCKBR
SCHEMBL5226505 0.88 GHSR (0.63) GHSRCCKBR
SCHEMBL5227028 0.88 GHSR (0.63) GHSRCCKBR
SCHEMBL5229155 0.88 GHSR (0.51) GHSRPPARACTSSPPARGKLK7
SCHEMBL5229159 0.88 GHSR (0.51) GHSRPPARACTSSPPARGKLK7
SCHEMBL5267040 0.88 GHSR (0.46) GHSRPPARACTSSPPARGKLK7
SCHEMBL5227354 0.83 GHSR (0.63) GHSRCCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6953791-B2 Dipeptide derivatives PFIZER, INC. (US) 2005-10-11 US disclosed
US-6951850-B2 Dipeptide derivatives PFIZER, INC. (US) 2005-10-04 US disclosed
US-6924280-B2 Dipeptide derivatives PFIZER INC. (US) 2005-08-02 US disclosed
US-RE38524-E1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2004-06-01 US disclosed
US-20040006063-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2004-01-08 US disclosed
US-20030216399-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2003-11-20 US disclosed
US-6525047-B2 Which are growth hormone secretogogues and increase the level of endogenous growth hormone; treating osteoporosis, congestive heart failure, frailty associated with aging, obesity; accelerating bone fracture repair PFIZER INC. 2003-02-25 US disclosed
US-6432945-B1 Dipeptide derivatives PFIZER INC. 2002-08-13 US disclosed
US-6433171-B1 FOR OSTEOPOROSIS AND/OR FRAILTY, CONGESTIVE HEART FAILURE, FRAILTY ASSOCIATED WITH AGING, OBESITY; ACCELERATING BONE FRACTURE REPAIR, ATTENUATING PROTEIN CATABOLIC RESPONSE AFTER A MAJOR OPERATION, REDUCING CACHEXIA AND PROTEIN LOSS PFIZER INC. 2002-08-13 US disclosed
US-20020042415-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2002-04-11 US disclosed
US-20010041703-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2001-11-15 US disclosed
US-6251902-B1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2001-06-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020042415-A1 Dipeptide derivatives GIPR, GHRHR, GHSR GHSR 3/4885PPARA 1854/4885CTSS 1873/4885
US-20010041703-A1 Dipeptide derivatives GIPR, GHRHR, GHSR GHSR 3/4885PPARA 1849/4885CTSS 2159/4885
US-20040006063-A1 Dipeptide derivatives GIPR, GHRHR, GHSR GHSR 3/4885PPARA 1586/4885CTSS 1947/4885
US-20030216399-A1 Dipeptide derivatives GIPR, GHRHR, GHSR GHSR 3/4885PPARA 1854/4885CTSS 1873/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.