SCHEMBL1459740

SCHEMBL1459740

CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc2[nH]nc(-c3cccnc3)c2c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 2/20 0.60
▸ MAP2K4 P45985 4/20 0.52
▸ LRRK2 Q5S007 2/20 0.50
▸ IDO1 P14902 1/20 0.50
▸ MAPK1 P28482 2/20 0.49
▸ ITK Q08881 2/20 0.48
▸ MAP2K7 O14733 2/20 0.48
▸ AURKA O14965 4/20 0.46
▸ PIM1 P11309 2/20 0.46
▸ TTK P33981 2/20 0.46
▸ MAPK3 P27361 1/20 0.46
▸ AURKB Q96GD4 2/20 0.45
▸ PIM3 Q86V86 1/20 0.45
▸ PIM2 Q9P1W9 1/20 0.45

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
SCHEMBL1460552 0.90 MAPK1 (0.54) NTRK1MAPK1ITKAURKATTK
SCHEMBL1460533 0.88 MAPK1 (0.64) NTRK1LRRK2MAPK1ITKAURKA
SCHEMBL1460842 0.88 MAPK1 (0.52) NTRK1MAPK1ITKAURKATTK
SCHEMBL4014552 0.85 TTK (0.56) MAP2K4LRRK2MAPK1ITKAURKA
SCHEMBL6297928 0.85 TTK (0.59) MAP2K4ITKMAP2K7AURKATTK
SCHEMBL1461732 0.85 AURKA (0.48) NTRK1MAPK1ITKAURKATTK
SCHEMBL1461810 0.85 ITK (0.57) NTRK1MAP2K4LRRK2MAPK1ITK
SCHEMBL1461867 0.85 MAPK1 (0.51) NTRK1MAP2K4LRRK2MAPK1ITK
SCHEMBL1461099 0.85 ITK (0.55) MAPK1ITKAURKATTKMAPK3
SCHEMBL1459746 0.84 AURKA (0.50) MAP2K4MAPK1ITKMAP2K7AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4643910-B2 — — 2011-03-02 — — JP claimed
US-7473701-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2009-01-06 — — US claimed
JP-2005533004-A — — 2005-11-04 — — JP claimed
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-03-17 — — 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-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 NTRK1 1342/4885MAP2K4 340/4885LRRK2 527/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 NTRK1 1376/4885MAP2K4 328/4885LRRK2 671/4885

“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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