SCHEMBL13925189

SCHEMBL13925189

C=C1CN(S(=O)(=O)c2ccc(C)cc2)CCCN(C(C)CC)CCCN(S(=O)(=O)c2ccc(C)cc2)C1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CD4 P01730 17/20 0.60
SORT1 Q99523 1/20 0.60
ALDH1A1 P00352 1/20 0.54
POLB P06746 1/20 0.54
PKM P14618 1/20 0.54
HTT P42858 1/20 0.54
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL13925187 0.87 LMNA (0.65) CD4SORT1ALDH1A1POLBPKM
SCHEMBL4114635 0.84 PKM (0.75) CD4SORT1ALDH1A1POLBPKM
SCHEMBL13925190 0.83 CD4 (0.64) CD4SORT1ALDH1A1POLBPKM
SCHEMBL13925188 0.81 CD4 (0.67) CD4SORT1ALDH1A1POLBPKM
SCHEMBL13925184 0.81 CD4 (0.66) CD4SORT1ALDH1A1POLBPKM
SCHEMBL13925171 0.80 KMT2A (0.71) CD4SORT1ALDH1A1POLBPKM
SCHEMBL13925185 0.80 CD4 (0.69) CD4SORT1ALDH1A1POLBPKM
SCHEMBL4268084 0.77 CD4 (0.65) CD4SORT1ALDH1A1POLBPKM
SCHEMBL4109195 0.77 KMT2A (0.62) CD4SORT1ALDH1A1POLBPKM
SCHEMBL6407569 0.77 CD4 (0.64) CD4SORT1ALDH1A1POLBPKM

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-20090048222-A1 Triaza Compound Immunoregulatory Agents BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO 2009-02-19 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-20090048222-A1 Triaza Compound Immunoregulatory Agents CD4, NFATC1, IKZF3 CD4 1/4885SORT1 4792/4885ALDH1A1 1749/4885

“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.