SCHEMBL1460985

SCHEMBL1460985

O=S(=O)(Cc1ccccc1)Nc1ccc2[nH]nc(-c3ccccc3)c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 5/20 0.67
AURKA O14965 5/20 0.67
TTK P33981 5/20 0.63
MAPK1 P28482 2/20 0.62
SGK1 O00141 1/20 0.60
BRD4 O60885 2/20 0.58
CYP19A1 P11511 1/20 0.55
MAPK3 P27361 1/20 0.52
DCLK1 O15075 1/20 0.48
PRKD3 O94806 1/20 0.48
MAP4K4 O95819 1/20 0.48
CHEK2 O96017 1/20 0.48
CSF1R P07333 1/20 0.48
FER P16591 1/20 0.48
CDK2 P24941 1/20 0.48
MARK3 P27448 1/20 0.48
FLT4 P35916 1/20 0.48
FLT3 P36888 1/20 0.48
MAPK9 P45984 1/20 0.48
CSNK1D P48730 1/20 0.48

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
SCHEMBL1460635 0.87 MAPK1 (0.81) AURKBAURKATTKMAPK1MAPK3
SCHEMBL1461088 0.84 MAPK1 (0.68) AURKBAURKATTKMAPK1BRD4
SCHEMBL5377449 0.84 CSNK1D (0.56) AURKBAURKATTKMAPK1SGK1
SCHEMBL1459717 0.82 MAPK1 (0.65) AURKBAURKATTKMAPK1SGK1
SCHEMBL5799339 0.82 TTK (0.55) AURKBAURKATTKSGK1CSNK1D
SCHEMBL1460755 0.82 MAPK1 (0.61) AURKBAURKATTKMAPK1MAPK3
SCHEMBL1461135 0.81 LRRK2 (0.55) AURKBAURKATTKMAPK1SGK1
SCHEMBL1461030 0.81 AURKA (0.67) AURKBAURKATTKMAPK1SGK1
SCHEMBL5383080 0.80 TTK (0.51) AURKBAURKATTKSGK1BRD4
SCHEMBL1460576 0.79 MAPK1 (0.57) AURKBAURKATTKMAPK1MAPK3

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 14 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-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 AURKB 33/4885AURKA 17/4885TTK 215/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 AURKB 67/4885AURKA 65/4885TTK 223/4885

“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.