SCHEMBL15840707

SCHEMBL15840707

CCc1ccc(NC(=S)Nc2ccc(S(=O)(=O)Nc3cc(Cl)cc(Cl)c3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.65
MAPT P10636 6/20 0.56
PPIA P62937 3/20 0.56
LMNA P02545 2/20 0.55
UCHL1 P09936 1/20 0.55
TP53 P04637 1/20 0.51
GHSR Q92847 1/20 0.50
POLB P06746 2/20 0.49
HPGD P15428 1/20 0.49
XBP1 P17861 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
IDH1 O75874 1/20 0.48
PPARG P37231 1/20 0.48

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
SCHEMBL15840629 0.86 ALDH1A1 (0.63) ALDH1A1MAPTPPIALMNAUCHL1
SCHEMBL15840701 0.86 MAPT (0.66) ALDH1A1MAPTPPIALMNAPOLB
SCHEMBL15840682 0.84 ALDH1A1 (0.67) ALDH1A1MAPTPPIALMNATP53
SCHEMBL15840810 0.84 LMNA (0.74) ALDH1A1MAPTPPIALMNAPOLB
SCHEMBL15840679 0.84 PPIA (0.57) ALDH1A1MAPTPPIALMNAGHSR
SCHEMBL15840815 0.83 ALDH1A1 (0.76) ALDH1A1MAPTPPIALMNAUCHL1
SCHEMBL15840663 0.82 PKM (0.59) ALDH1A1MAPTPPIALMNAKMT2A
SCHEMBL15840508 0.82 ALDH1A1 (0.57) ALDH1A1MAPTPPIALMNAHTT
SCHEMBL15840434 0.81 MAPT (0.70) ALDH1A1MAPTPPIALMNAKMT2A
SCHEMBL15840729 0.81 PPIA (0.70) ALDH1A1MAPTPPIALMNAHTT

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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 ALDH1A1 4348/4885MAPT 1076/4885PPIA 1884/4885

“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.