SCHEMBL5416243

SCHEMBL5416243

CCN(C(=O)C=C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)N(C)C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.47
ACE P12821 1/20 0.46
CTSK P43235 8/20 0.45
CTSS P25774 3/20 0.45
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.42
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.42
APP P05067 1/20 0.42
REN P00797 1/20 0.42

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
SCHEMBL5408433 0.92 ATM (0.47) ATMACECTSKCTSSCTSL
SCHEMBL2736190 0.84 ATM (0.61) ATMACECTSKCTSSCTSL
SCHEMBL12137049 0.84 ATM (0.61) ATMACECTSKCTSSCTSL
SCHEMBL5411880 0.83 ATM (0.45) ATMACECTSKCTSSCTSL
SCHEMBL4275630 0.83 ATM (0.55) ATMACECTSKCTSSCTSL
SCHEMBL5821214 0.83 ATM (0.55) ATMACECTSKCTSSCTSL
SCHEMBL30289939 0.83 ATM (0.55) ATMACECTSKCTSSCTSL
SCHEMBL5414321 0.83 ATM (0.55) ATMACECTSKCTSSCTSL
SCHEMBL4275633 0.83 ATM (0.55) ATMACECTSKCTSSCTSL
SCHEMBL5408260 0.83 ATM (0.55) ATMACECTSKCTSSCTSL

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-7202269-B2 GlyT2 modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-10 US disclosed
US-20050119245-A1 GlyT2 modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-06-02 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-20050119245-A1 GlyT2 modulators GLRB, GLRA1, GLRA2 ATM 2145/4885ACE 2817/4885CTSK 4240/4885

“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.