SCHEMBL738022

SCHEMBL738022

CC(=O)N[C@@H](Cc1cccc2ccccc12)NC(=O)[C@@H](Cc1csc2ccccc12)NC(=O)C1(N)CCNCC1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.64
TACR1 P25103 2/20 0.39
MMP9 P14780 4/20 0.38
KLKB1 P03952 3/20 0.38
MMP8 P22894 3/20 0.38
MMP2 P08253 2/20 0.38
CTSS P25774 2/20 0.38
CTSK P43235 2/20 0.38
CTSL P07711 1/20 0.38
OPRD1 P41143 1/20 0.37
MMP14 P50281 1/20 0.37
KLK1 P06870 2/20 0.37
F10 P00742 2/20 0.35
MME P08473 1/20 0.35
ACE P12821 1/20 0.35
CPA1 P15085 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
PIN1 Q13526 1/20 0.34
CALCRL Q16602 1/20 0.34

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
SCHEMBL737042 1.00 GHSR (0.64) GHSRTACR1MMP9KLKB1MMP8
SCHEMBL739069 0.94 GHSR (0.71) GHSRTACR1MMP9KLKB1MMP8
SCHEMBL737831 0.90 GHSR (0.64) GHSRMMP9KLKB1MMP8MMP2
SCHEMBL739067 0.90 GHSR (0.64) GHSRMMP9KLKB1MMP8MMP2
SCHEMBL737925 0.89 GHSR (0.60) GHSRTACR1MMP9KLKB1MMP8
SCHEMBL738034 0.89 GHSR (0.60) GHSRTACR1MMP9KLKB1MMP8
SCHEMBL738032 0.88 GHSR (0.85) GHSRTACR1MMP9MMP8
SCHEMBL739684 0.88 GHSR (0.85) GHSRTACR1MMP9MMP8
SCHEMBL739284 0.84 GHSR (0.63) GHSRTACR1MMP9KLKB1MMP8
SCHEMBL738004 0.84 GHSR (0.63) GHSRTACR1MMP9KLKB1MMP8

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 1/4885TACR1 489/4885MMP9 3107/4885

“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.