SCHEMBL5512695

SCHEMBL5512695

O=Cc1c(-c2ccc(Cl)c(S(=O)(=O)NC3CCCCC3)c2)[nH]c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 6/20 0.53
▸ ALDH1A1 P00352 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ GAA P10253 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.41
▸ MAPT P10636 1/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ PARG Q86W56 1/20 0.38
▸ PI4KB Q9UBF8 1/20 0.38
▸ CCR8 P51685 1/20 0.38
▸ BRD2 P25440 1/20 0.38
▸ BRD3 Q15059 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
SCHEMBL13774518 0.87 BRD4 (0.53) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL3993378 0.85 BRD4 (0.52) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL4140009 0.84 BRD4 (0.51) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL27751379 0.83 BRD4 (0.50) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL5514824 0.82 BRD4 (0.49) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL2874923 0.82 BRD4 (0.49) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL5621496 0.82 BRD4 (0.45) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL13774339 0.82 BRD4 (0.48) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL5511290 0.82 BRD4 (0.48) BRD4ALDH1A1L3MBTL1GAAHTT
SCHEMBL5512629 0.81 BRD4 (0.50) BRD4ALDH1A1L3MBTL1GAAHTT

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-20070265278-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS AVENTIS PHARMACEUTICALS INC. (US) 2007-11-15 — — US disclosed
EP-1844011-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS Aventis Pharmaceuticals Inc. (US) 2007-10-17 — — EP disclosed
WO-2006081343-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS AVENTIS PHARMACEUTICALS INC. (US) 2006-08-03 — — 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-20070265278-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS PTGDR2, PTGDR, CYSLTR2 BRD4 2086/4885ALDH1A1 1779/4885L3MBTL1 3567/4885

“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.

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