SCHEMBL1460649

SCHEMBL1460649

O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc2[nH]nc(-c3ccccc3)c2c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 2/20 0.58
▸ MAPT P10636 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ AURKA O14965 4/20 0.51
▸ AURKB Q96GD4 3/20 0.51
▸ HSPD1 P10809 1/20 0.50
▸ PTPN2 P17706 1/20 0.50
▸ PTPN1 P18031 1/20 0.50
▸ PTPN5 P54829 1/20 0.50
▸ HSPE1 P61604 1/20 0.50
▸ ITK Q08881 1/20 0.49
▸ TTK P33981 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ NR1I2 O75469 1/20 0.48
▸ AR P10275 1/20 0.47

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
SCHEMBL1460534 0.84 ITK (0.66) AURKAAURKBPTPN2PTPN1PTPN5
SCHEMBL1460982 0.83 AURKA (0.69) LRRK2MAPTHPGDAURKAAURKB
SCHEMBL4004253 0.83 LRRK2 (0.48) LRRK2MAPTHPGDGAASMN1; SMN2
SCHEMBL1461135 0.82 LRRK2 (0.55) LRRK2MAPTHPGDAURKAAURKB
SCHEMBL1460661 0.82 ITK (0.55) MAPTHPGDAURKAAURKBPTPN2
SCHEMBL1460552 0.82 MAPK1 (0.54) AURKAAURKBITKTTK
SCHEMBL1461110 0.82 TTK (0.55) AURKAAURKBPTPN2PTPN1PTPN5
SCHEMBL1460664 0.81 MAPT (0.54) LRRK2MAPTHPGDGAASMN1; SMN2
SCHEMBL1461033 0.81 TTK (0.54) MAPTAURKAAURKBPTPN2PTPN1
SCHEMBL1460698 0.81 MAPT (0.62) MAPTHPGDAURKAAURKBHSPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4643910-B2 — — 2011-03-02 — — JP claimed
JP-2005533004-A — — 2005-11-04 — — JP claimed
US-6858638-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-02-22 — — US claimed
EP-1487803-A1 INDAZOLES SUBSTITUTED WITH AN ANTI-CANCEROUS ACTIVITY Aventis Pharma S.A. (FR) 2004-12-22 — — EP claimed
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 — — US claimed
WO-2003078402-A1 INDAZOLES SUBSTITUTED WITH AN ANTI-CANCEROUS ACTIVITY AVENTIS PHARMA S.A. (FR) 2003-09-25 — — WO claimed
US-7473701-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2009-01-06 — — US disclosed
US-7473701-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2009-01-06 — — US disclosed
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-03-17 — — US disclosed
US-6858638-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-02-22 — — US disclosed
EP-1487803-A1 INDAZOLES SUBSTITUTED WITH AN ANTI-CANCEROUS ACTIVITY Aventis Pharma S.A. (FR) 2004-12-22 — — EP disclosed
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 — — US disclosed
WO-2003078402-A1 INDAZOLES SUBSTITUTED WITH AN ANTI-CANCEROUS ACTIVITY AVENTIS PHARMA S.A. (FR) 2003-09-25 — — 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 (2 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-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 LRRK2 527/4885MAPT 2426/4885HPGD 1246/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 LRRK2 671/4885MAPT 3070/4885HPGD 1303/4885

“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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