SCHEMBL20104607

SCHEMBL20104607

CSCC(C)C[C@H](CCCNC(=N)N)NC(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL21941031 0.88 MEN1 (0.34) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL21541171 0.85 MEN1 (0.33) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL20104610 0.85 MEN1 (0.36) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL24529722 0.79 MEN1 (0.36) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL20104600 0.77 MEN1 (0.35) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL16260138 0.73 MEN1 (0.39) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL21559872 0.73 MEN1 (0.34) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL13254058 0.72 ITGB3 (0.34) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL23489658 0.72 ITGB3 (0.34) MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL22413623 0.70 KISS1R (0.39) MEN1CYP1A2KMT2ASMN1; SMN2

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-10640544-B2 Antibody-coupled cyclic peptide tyrosine tyrosine compounds as modulators of neuropeptide Y receptors JANSSEN PHARMACEUTICA NV (BE) 2020-05-05 US disclosed
US-20180117170-A1 ANTIBODY-COUPLED CYCLIC PEPTIDE TYROSINE TYROSINE COMPOUNDS AS MODULATORS OF NEUROPEPTIDE Y RECEPTORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 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-10640544-B2 Antibody-coupled cyclic peptide tyrosine tyrosine compounds as modulators of neuropeptide Y receptors NPY1R, NPY5R, NPY2R MEN1 1303/4885CYP1A2 4749/4885KMT2A 2481/4885
US-20180117170-A1 ANTIBODY-COUPLED CYCLIC PEPTIDE TYROSINE TYROSINE COMPOUNDS AS MODULATORS OF NEUROPEPTIDE Y RECEPTORS NPY1R, NPY5R, NPY2R MEN1 1303/4885CYP1A2 4749/4885KMT2A 2481/4885

“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.