SCHEMBL15840663

SCHEMBL15840663

Cc1ccc(NC(=S)Nc2ccc(S(=O)(=O)Nc3cc(Cl)cc(Cl)c3)cc2)cc1C

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.59
ALDH1A1 P00352 3/20 0.58
MAPT P10636 2/20 0.58
LMNA P02545 1/20 0.58
PPIA P62937 5/20 0.56
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
IDH1 O75874 1/20 0.50
GPR27 Q9NS67 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
SCHEMBL15840434 0.91 MAPT (0.70) PKMALDH1A1MAPTLMNAPPIA
SCHEMBL15840701 0.88 MAPT (0.66) ALDH1A1MAPTLMNAPPIAMEN1
SCHEMBL15840810 0.86 LMNA (0.74) ALDH1A1MAPTLMNAPPIAMEN1
SCHEMBL15840811 0.85 MAPT (0.70) ALDH1A1MAPTLMNAPPIAMEN1
SCHEMBL15840508 0.85 ALDH1A1 (0.57) ALDH1A1MAPTLMNAPPIAMEN1
SCHEMBL13453919 0.84 PKM (0.58) PKMALDH1A1MAPTLMNAPPIA
SCHEMBL15840679 0.84 PPIA (0.57) PKMALDH1A1MAPTLMNAPPIA
SCHEMBL15840655 0.82 ALDH1A1 (0.71) PKMALDH1A1MAPTLMNAPPIA
SCHEMBL15840707 0.82 ALDH1A1 (0.65) ALDH1A1MAPTLMNAPPIAKMT2A
SCHEMBL15840660 0.82 PPIA (0.62) PKMALDH1A1MAPTLMNAPPIA

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 PKM 4157/4885ALDH1A1 4348/4885MAPT 1076/4885

“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.