SCHEMBL6327438

SCHEMBL6327438

N[C@@H](Cc1cn(CCC2CCCCC2)cn1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 14/20 0.69
CPB1 P15086 8/20 0.69
KDM4C Q9H3R0 1/20 0.50
LNPEP Q9UIQ6 1/20 0.39
TPH1 P17752 1/20 0.39

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
SCHEMBL8346107 0.86 CPB2 (0.61) CPB2CPB1KDM4CLNPEP
SCHEMBL6248361 0.82 CPB2 (0.74) CPB2CPB1KDM4CLNPEP
SCHEMBL8346104 0.82 CPB2 (0.62) CPB2CPB1KDM4CLNPEP
SCHEMBL6493209 0.82 CPB2 (1.00) CPB2CPB1KDM4C
Hydrochloric Acid SCHEMBL6484890 0.82 CPB2 (0.73) CPB2CPB1KDM4CLNPEP
Hydrochloric Acid SCHEMBL6484886 0.82 CPB2 (0.67) CPB2CPB1KDM4CLNPEP
Hydrochloric Acid SCHEMBL6485970 0.82 CPB2 (0.67) CPB2CPB1KDM4CLNPEP
Hydrochloric Acid SCHEMBL6485972 0.82 CPB2 (0.73) CPB2CPB1KDM4CLNPEP
SCHEMBL6493995 0.80 CPB2 (0.71) CPB2CPB1KDM4C
SCHEMBL6917738 0.80 CPB2 (0.71) CPB2CPB1KDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919457-B2 3-(imidazolyl)-2-aminopropanoic acids PFIZER, INC. (US) 2005-07-19 US disclosed
US-20040192668-A1 3-(imidazolyl)-2-aminopropanoic acids PFIZER INC 2004-09-30 US disclosed
US-6759426-B2 RESPIRATORY SYSTREM DISORDERS; ANTIINFLAMMATORY AGENTS; RHEUMATIC DISORDERS PFIZER INC 2004-07-06 US disclosed
US-20030191107-A1 3-(Imidazolyl)-2-aminopropanoic acids PFIZER INC. 2003-10-09 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 (2 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-20040192668-A1 3-(imidazolyl)-2-aminopropanoic acids FGB, F2, F11 CPB2 733/4885CPB1 1085/4885KDM4C 3415/4885
US-20030191107-A1 3-(Imidazolyl)-2-aminopropanoic acids FGB, F2, F11 CPB2 733/4885CPB1 1085/4885KDM4C 3415/4885

“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.