SCHEMBL739684

SCHEMBL739684

CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1csc2ccccc12)NC(=O)C1(N)CCNCC1

nearest known ligand 0.85

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.85
OPRM1 P35372 1/20 0.47
KMT2A Q03164 2/20 0.44
ECE1 P42892 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TACR1 P25103 1/20 0.42
BCL2A1 Q16548 2/20 0.41
BID P55957 1/20 0.41
MAPT P10636 2/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
ALOX15 P16050 1/20 0.40
MEN1 O00255 1/20 0.40
HCRTR1 O43613 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL738032 1.00 GHSR (0.85) GHSROPRM1KMT2AECE1MAPK1
SCHEMBL739069 0.93 GHSR (0.71) GHSROPRM1TACR1MMP9MMP8
SCHEMBL737834 0.90 GHSR (0.85) GHSROPRM1KMT2AECE1SMN1; SMN2
SCHEMBL739292 0.90 GHSR (0.85) GHSROPRM1KMT2AECE1SMN1; SMN2
SCHEMBL738022 0.88 GHSR (0.64) GHSRTACR1MMP9MMP8
SCHEMBL737042 0.88 GHSR (0.64) GHSRTACR1MMP9MMP8
SCHEMBL737925 0.85 GHSR (0.60) GHSROPRM1TACR1MMP9MMP8
SCHEMBL738034 0.85 GHSR (0.60) GHSRTACR1MMP9MMP8
SCHEMBL739664 0.84 GHSR (0.84) GHSROPRM1KMT2AECE1MAPK1
SCHEMBL737830 0.84 GHSR (0.84) GHSROPRM1KMT2AECE1MAPK1

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 3398/4885KMT2A 3668/4885

“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.