SCHEMBL3117446

SCHEMBL3117446

Cc1cc(=O)n(-c2ccc(NS(=O)(=O)c3ccc(C)c(C)c3)cn2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
THRB P10828 1/20 0.46
TP53 P04637 3/20 0.45
PKM P14618 8/20 0.44
GAA P10253 2/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.42
NOD2 Q9HC29 1/20 0.42
PKLR P30613 2/20 0.42
MLNR O43193 1/20 0.40

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
SCHEMBL3107793 0.87 KIT (0.49) LMNAPKMGAAKMT2AMEN1
SCHEMBL13248894 0.87 KIT (0.47) LMNATHRBGAAKMT2AMEN1
SCHEMBL13248887 0.87 KMT2A (0.56) GAAKMT2AMEN1ALDH1A1MAPT
SCHEMBL13248893 0.86 KMT2A (0.45) LMNATHRBTP53PKMGAA
SCHEMBL4661391 0.86 ALDH1A1 (0.46) LMNAPKMGAAKMT2AMEN1
SCHEMBL13248890 0.86 KMT2A (0.50) LMNAPKMGAAKMT2AMEN1
SCHEMBL13248881 0.86 KIT (0.48) LMNATP53GAAKMT2AMEN1
SCHEMBL13248884 0.85 KIT (0.49) LMNATHRBTP53PKMGAA
SCHEMBL13248896 0.85 ALDH1A1 (0.47) LMNAGAAKMT2AMEN1ALDH1A1
SCHEMBL13248872 0.85 GAA (0.57) LMNAPKMGAAKMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 US disclosed
EP-1919890-A1 PYRAZOLONE DERIVATIVES FOR THE TREATMENT OF TUBERCULOSIS AstraZeneca AB (SE) 2008-05-14 EP disclosed
WO-2007020426-A1 PYRAZOLONE DERIVATIVES FOR THE TREATMENT OF TUBERCULOSIS ASTRAZENECA AB (SE) 2007-02-22 WO 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-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS TREH, TYMP, EPX LMNA 1808/4885THRB 311/4885TP53 2800/4885

“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.