SCHEMBL737045

SCHEMBL737045

CCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1csc2ccccc12)NC(=O)C(C)(C)N

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 10/20 0.65
OPRM1 P35372 1/20 0.65
ACE P12821 2/20 0.47
MMP9 P14780 4/20 0.46
MMP8 P22894 4/20 0.46
MMP2 P08253 4/20 0.46
CCKBR P32239 1/20 0.46
MMP1 P03956 2/20 0.45
MMP3 P08254 1/20 0.45
MEN1 O00255 1/20 0.43
HCRTR1 O43613 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL736965 0.94 GHSR (0.66) GHSROPRM1ACEMMP9MMP8
SCHEMBL736964 0.92 GHSR (0.69) GHSROPRM1ACEMMP9MMP8
SCHEMBL736961 0.91 GHSR (0.68) GHSROPRM1ACEKMT2A
SCHEMBL736840 0.91 GHSR (0.68) GHSROPRM1ACEMMP9MMP8
SCHEMBL737846 0.91 GHSR (0.68) GHSROPRM1ACEKMT2A
SCHEMBL737076 0.91 GHSR (0.68) GHSROPRM1ACEKMT2A
SCHEMBL737019 0.88 GHSR (0.85) GHSROPRM1ACEMMP9MMP8
SCHEMBL736951 0.88 GHSR (0.85) GHSROPRM1ACEMMP9MMP8
SCHEMBL738184 0.87 GHSR (0.65) GHSROPRM1ACEMMP9MMP8
SCHEMBL737524 0.87 GHSR (0.65) GHSROPRM1ACEMMP9MMP8

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-8138218-B2 Growth hormone secretagogues IPSEN PHARMA S.A.S. (FR) 2012-03-20 US disclosed
US-20090131478-A1 Growth Hormone Secretagogues IPSEN PHARMA S.A.S. (FR) 2009-05-21 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 (1 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-20090131478-A1 Growth Hormone Secretagogues GHSR, GHRHR, GHITM GHSR 1/4885OPRM1 3398/4885ACE 1754/4885

“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.