SCHEMBL736946

SCHEMBL736946

CC(C)(N)C(=O)N[C@H](Cc1csc2ccccc12)C(=O)N[C@H](Cc1cccc2ccccc12)NC=O

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.61
OPRM1 P35372 1/20 0.61
CTSS P25774 2/20 0.45
CTSK P43235 2/20 0.45
CTSL P07711 1/20 0.45
MMP9 P14780 4/20 0.41
MMP8 P22894 3/20 0.41
MMP2 P08253 2/20 0.41
MMP14 P50281 1/20 0.40
TACR1 P25103 1/20 0.38
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
KLKB1 P03952 3/20 0.37
KLK1 P06870 2/20 0.37
F10 P00742 2/20 0.36
HRH4 Q9H3N8 1/20 0.36
OPRD1 P41143 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
SCHEMBL736854 1.00 GHSR (0.61) GHSROPRM1CTSSCTSKCTSL
SCHEMBL737099 0.94 GHSR (0.68) GHSROPRM1CTSSCTSKCTSL
SCHEMBL736941 0.92 GHSR (0.71) GHSROPRM1CTSSCTSKMMP9
SCHEMBL737525 0.89 GHSR (0.47) GHSROPRM1CTSSCTSKCTSL
SCHEMBL736852 0.89 GHSR (0.47) GHSROPRM1CTSSCTSKCTSL
SCHEMBL736985 0.87 GHSR (0.56) GHSROPRM1CTSSCTSKCTSL
SCHEMBL737824 0.87 GHSR (0.56) GHSROPRM1CTSSCTSKCTSL
SCHEMBL736855 0.87 GHSR (0.45) GHSROPRM1CTSSCTSKCTSL
SCHEMBL737102 0.87 GHSR (0.45) GHSROPRM1CTSSCTSKCTSL
SCHEMBL736951 0.85 GHSR (0.85) GHSROPRM1CTSSCTSKCTSL

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 3398/4885CTSS 886/4885

“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.