SCHEMBL738034

SCHEMBL738034

CC(=O)N[C@@H](Cc1csc2ccccc12)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)C1(N)CCNCC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.60
TACR1 P25103 3/20 0.39
KLKB1 P03952 3/20 0.38
KLK1 P06870 2/20 0.38
MC1R Q01726 5/20 0.37
MC4R P32245 3/20 0.37
MC3R P41968 3/20 0.37
MMP9 P14780 2/20 0.36
MMP8 P22894 2/20 0.36
OPRD1 P41143 1/20 0.36
MC5R P33032 2/20 0.35
MMP2 P08253 1/20 0.35
CTSL P07711 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMB5 P28074 1/20 0.35
PSMB2 P49721 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
SCHEMBL737925 0.97 GHSR (0.60) GHSRTACR1KLKB1KLK1MC1R
SCHEMBL14615484 0.93 GHSR (0.51) GHSRTACR1KLKB1KLK1MC1R
SCHEMBL739069 0.91 GHSR (0.71) GHSRTACR1KLKB1KLK1MMP9
SCHEMBL737835 0.90 GHSR (0.60) GHSRTACR1KLKB1KLK1MC1R
SCHEMBL738022 0.89 GHSR (0.64) GHSRTACR1KLKB1KLK1MMP9
SCHEMBL737042 0.89 GHSR (0.64) GHSRTACR1KLKB1KLK1MMP9
SCHEMBL736832 0.87 GHSR (0.60) GHSRTACR1KLKB1KLK1MC1R
SCHEMBL739671 0.86 GHSR (0.59) GHSRTACR1KLKB1KLK1MC1R
SCHEMBL739684 0.85 GHSR (0.85) GHSRTACR1MMP9MMP8
SCHEMBL738032 0.85 GHSR (0.85) GHSRTACR1MMP9MMP8

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 489/4885KLKB1 1400/4885

“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.