SCHEMBL737834

SCHEMBL737834

NC1(C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](Cc2csc3ccccc23)NC=O)CCNCC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.85
OPRM1 P35372 1/20 0.58
HTT P42858 4/20 0.41
MAPT P10636 3/20 0.41
HCRTR1 O43613 2/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
FPR1 P21462 1/20 0.38
FPR2 P25090 1/20 0.38
HDAC3 O15379 4/20 0.38
HDAC4 P56524 4/20 0.38
HDAC1 Q13547 4/20 0.38
HDAC7 Q8WUI4 4/20 0.38
HDAC2 Q92769 4/20 0.38
HDAC10 Q969S8 4/20 0.38

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
SCHEMBL739292 1.00 GHSR (0.85) GHSROPRM1HTTMAPTHCRTR1
SCHEMBL739675 0.93 GHSR (0.71) GHSROPRM1
SCHEMBL739684 0.90 GHSR (0.85) GHSROPRM1HTTMAPTHCRTR1
SCHEMBL738032 0.90 GHSR (0.85) GHSROPRM1HTTMAPTHCRTR1
SCHEMBL737831 0.88 GHSR (0.64) GHSROPRM1
SCHEMBL739067 0.88 GHSR (0.64) GHSROPRM1
SCHEMBL736832 0.85 GHSR (0.60) GHSROPRM1
SCHEMBL737835 0.85 GHSR (0.60) GHSROPRM1
SCHEMBL739061 0.85 GHSR (0.84) GHSROPRM1HDAC3HDAC4HDAC1
SCHEMBL736960 0.85 GHSR (0.84) GHSROPRM1HDAC3HDAC4HDAC1

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 3398/4885HTT 944/4885

“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.