SCHEMBL2920694

SCHEMBL2920694

CS(=O)(=O)c1ccc2c(C(=O)O)c[nH]c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.53
▸ TDO2 P48775 1/20 0.47
▸ HPGD P15428 3/20 0.45
▸ GAA P10253 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ F7 P08709 1/20 0.45
▸ F3 P13726 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NR4A2 P43354 2/20 0.44
▸ PTGS2 P35354 3/20 0.44
▸ PTGS1 P23219 2/20 0.44
▸ PRKAB2 O43741 2/20 0.43
▸ PRKAG1 P54619 2/20 0.43
▸ PRKAA2 P54646 2/20 0.43

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
SCHEMBL1558375 0.89 TDO2 (0.44) LMNATDO2HPGDGAAHSD17B10
SCHEMBL3632702 0.88 ALDH1A1 (0.53) LMNATDO2MAPTALDH1A1NR4A2
SCHEMBL23612225 0.87 GAA (0.58) LMNAHPGDGAAHSD17B10MAPT
SCHEMBL2079006 0.83 CNR1 (0.47) LMNATDO2MAPTNR4A2PTGS2
SCHEMBL2916325 0.81 KDM4E (0.54) LMNAHPGDGAAHSD17B10MAPT
SCHEMBL2922964 0.81 KDM4E (0.54) LMNAHPGDGAAHSD17B10MAPT
SCHEMBL6598809 0.80 TDO2 (0.49) TDO2PTGS2PTGS1
SCHEMBL27816683 0.78 TDO2 (0.48) TDO2ALDH1A1PTGS2PTGS1
SCHEMBL1558851 0.77 POLB (0.48) LMNAHPGDGAAHSD17B10MAPT
SCHEMBL2659416 0.76 NR4A2 (0.71) LMNAHPGDHSD17B10MAPTF7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478624-B1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2010-09-08 — — EP disclosed
US-7709500-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-05-04 — — US disclosed
US-7709500-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-05-04 — — US disclosed
CN-100564358-C The method of a kind of preparation 4-(3, the 4-dichlorophenoxy) piperidines ASTRAZENECA AB (SE) 2009-12-02 — — CN disclosed
CN-100352807-C substituted piperidine compounds ASTRAZENECA AB (SE) 2007-12-05 — — CN disclosed
CN-1907968-A Method for making 4-(3,4-dichlorophenoxy)piperidine ASTRAZENECA AB (SE) 2007-02-07 — — CN disclosed
CN-1633414-A Compound (I) ASTRAZENECA AB (SE) 2005-06-29 — — CN disclosed
US-20050107428-A1 Chemical compounds ASTRAZENECA AB (SE) 2005-05-19 — — US disclosed
EP-1478624-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2004-11-24 — — EP disclosed
WO-2003068743-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2003-08-21 — — 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-20050107428-A1 Chemical compounds CCR10, CCR3, CXCR5 LMNA 4760/4885TDO2 1294/4885HPGD 1414/4885

“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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