SCHEMBL13870930

SCHEMBL13870930

O=C(Nc1ccccc1C(=O)O)c1cc(S(=O)(=O)N2CCCC2)c(Cl)cc1Cl

nearest known ligand 0.98

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.98
MEN1 O00255 7/20 0.98
ALDH1A1 P00352 3/20 0.65
LMNA P02545 3/20 0.65
SMN1; SMN2 Q16637 5/20 0.64
MAPK1 P28482 1/20 0.64
TP53 P04637 4/20 0.62
ENPP2 Q13822 1/20 0.61
POLB P06746 1/20 0.61
SLC16A1 P53985 1/20 0.57
CNR1 P21554 1/20 0.54
TDP1 Q9NUW8 2/20 0.54
THRB P10828 1/20 0.53
GAA P10253 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GFER P55789 1/20 0.51

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
SCHEMBL13870898 0.99 MEN1 (1.00) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL17109121 0.85 ENPP2 (0.79) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL13870923 0.84 KMT2A (0.98) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL13870919 0.83 KMT2A (1.00) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL4760580 0.81 MEN1 (0.97) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL4716208 0.80 MEN1 (1.00) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL4716285 0.80 MEN1 (1.00) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL4761472 0.79 MEN1 (0.91) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL13870901 0.77 TP53 (1.00) KMT2AMEN1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL1094889 0.77 TP53 (1.00) KMT2AMEN1ALDH1A1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105218-A1 CRTH2 Receptor Ligands For Therapeutic Use 7TM PHARMA A/S (DK) 2009-04-23 US disclosed
US-20090105218-A1 CRTH2 Receptor Ligands For Therapeutic Use 7TM PHARMA A/S (DK) 2009-04-23 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-20090105218-A1 CRTH2 Receptor Ligands For Therapeutic Use NR1H2, NR1H3, HRH2 KMT2A 2570/4885MEN1 2859/4885ALDH1A1 787/4885

“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.