SCHEMBL7204023

SCHEMBL7204023

CNC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@@H](Cc1csc2ccccc12)N(C)C(=O)c1cccc(C(C)(N)N)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
CTSL P07711 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
TP53 P04637 2/20 0.36
OPRD1 P41143 3/20 0.36
OPRM1 P35372 2/20 0.36
OPRK1 P41145 2/20 0.36
MAPT P10636 1/20 0.34
PYGL P06737 1/20 0.34
KLKB1 P03952 1/20 0.33
KLK1 P06870 1/20 0.33

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
SCHEMBL6319923 0.89 TP53 (0.39) TACR1MMP2MMP9MMP8CTSL
SCHEMBL6325996 0.87 MMP2 (0.38) TACR1MMP2MMP9MMP8CTSL
SCHEMBL6319699 0.83 KLKB1 (0.43) TACR1MMP2MMP9MMP8TP53
SCHEMBL6319686 0.82 MMP2 (0.44) TACR1MMP2MMP9MMP8CTSL
SCHEMBL6318941 0.82 TP53 (0.37) TACR1MMP2MMP9MMP8TP53
SCHEMBL6319162 0.82 TP53 (0.37) TACR1MMP2MMP9MMP8TP53
SCHEMBL6325830 0.81 CTSL (0.48) TACR1MMP2MMP9MMP8CTSL
SCHEMBL6319176 0.80 KLKB1 (0.37) TACR1MMP2MMP9MMP8OPRD1
SCHEMBL6319016 0.79 GHSR (0.49) MMP2MMP9MMP8CTSLCTSS
SCHEMBL6324008 0.79 CTSL (0.39) TACR1MMP2MMP9MMP8CTSL

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030040483-A1 Compounds with growth hormone releasing properties HELSINN THERAPEUTICS (U.S.), INC. 2003-02-27 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-20030040483-A1 Compounds with growth hormone releasing properties GHRHR, GHSR, GRPR TACR1 232/4885MMP2 2624/4885MMP9 3090/4885

“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.