SCHEMBL2873172

SCHEMBL2873172

CCN(c1cccc(OC)c1)S(=O)(=O)c1cc(-c2[nH]c3ccccc3c2C(=O)C(=O)OC)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.43
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2873358 0.92 MEN1 (0.47) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL2873468 0.87 ESR1 (0.43) ESR1MAPTMEN1KMT2ALMNA
SCHEMBL2872281 0.86 ESR1 (0.44) ESR1MAPTMEN1KMT2ALMNA
SCHEMBL2878341 0.86 ALDH1A1 (0.47) ESR1MEN1KMT2AALDH1A1
SCHEMBL2869095 0.84 MEN1 (0.50) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL2878396 0.81 ALDH1A1 (0.38) MEN1KMT2AALDH1A1
SCHEMBL2873169 0.79 ACLY (0.51) MAPTALDH1A1SMN1; SMN2
SCHEMBL2878353 0.78 MEN1 (0.47) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL2875356 0.77 KMT2A (0.50) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL2873354 0.75 ALDH1A1 (0.52) MAPTLMNAALDH1A1SMN1; SMN2

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
EP-2066628-B1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI AVENTIS (FR) 2010-10-20 EP disclosed
US-20090176804-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2009-07-09 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-20090176804-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS PTGER2, PTGDR2, CYSLTR2 ESR1 1686/4885MAPT 2271/4885MEN1 4753/4885

“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.