SCHEMBL4284511

SCHEMBL4284511

NC(=O)c1cc(N)c(Cl)c(S(=O)(=O)O)c1NCc1ccco1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.51
ALDH1A1 P00352 5/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HTR1A P08908 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
HSD11B1 P28845 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
SLC10A1 Q14973 1/20 0.47
CA9 Q16790 1/20 0.47
GPR35 Q9HC97 1/20 0.47
CISD1 Q9NZ45 1/20 0.47
CA14 Q9ULX7 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
CA5B Q9Y2D0 1/20 0.47
LMNA P02545 1/20 0.42
GAA P10253 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
SCHEMBL230407 0.76 ALDH1A1 (0.55) APPALDH1A1CA12CA1CA2
Dimethylamine SCHEMBL230218 0.71 APP (0.55) APPALDH1A1CA12CA1CA2
SCHEMBL29436041 0.70 APP (0.60) APPALDH1A1CA12CA1CA2
SCHEMBL17774918 0.70 ALDH1A1 (0.55) APPALDH1A1CA12CA1CA2
SCHEMBL27846292 0.70 APP (0.45) APPALDH1A1CA12CA1CA2
SCHEMBL27846282 0.70 ALDH1A1 (0.42) APPALDH1A1CA12CA1CA2
SCHEMBL229073 0.70 CA12 (0.85) APPALDH1A1CA12CA1CA2
SCHEMBL230217 0.69 ALDH1A1 (0.52) APPALDH1A1CA12CA1CA2
SCHEMBL11819699 0.69 APP (0.80) APPALDH1A1CA12CA1CA2
SCHEMBL27846281 0.69 APP (0.39) APPALDH1A1CA12CA1CA2

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-20090215754-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEUROPSYCHIATRIC AND ADDICTIVE DISORDERS NEUROTHERAPEUTICS PHARMA, INC. 2009-08-27 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-20090215754-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEUROPSYCHIATRIC AND ADDICTIVE DISORDERS SLC6A2, SLC1A2, SLC18A2 APP 1900/4885ALDH1A1 701/4885CA12 1302/4885

“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.