SCHEMBL1460717

SCHEMBL1460717

O=S(=O)(Nc1ccc2[nH]ncc2c1)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.80
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
MAPK1 P28482 1/20 0.60
LMNA P02545 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
PIK3CD O00329 2/20 0.59
ROCK2 O75116 3/20 0.57
ROCK1 Q13464 3/20 0.57
NPC1 O15118 1/20 0.56
JAK2 O60674 1/20 0.56
RAB9A P51151 1/20 0.56
ACLY P53396 1/20 0.55
CASP6 P55212 2/20 0.52
BRD4 O60885 1/20 0.51
PKM P14618 1/20 0.51

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
SCHEMBL10586698 0.86 MEN1 (0.61) ALDH1A1MEN1KMT2AMAPK1LMNA
SCHEMBL4004408 0.85 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AMAPK1PIK3CD
SCHEMBL2845149 0.83 MEN1 (0.65) ALDH1A1MEN1KMT2AMAPK1PIK3CD
SCHEMBL1460561 0.81 MEN1 (0.66) ALDH1A1MEN1KMT2AMAPK1ROCK2
SCHEMBL5491142 0.81 MEN1 (1.00) ALDH1A1MEN1KMT2AMAPK1ROCK2
SCHEMBL1460530 0.81 MEN1 (0.73) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL4014193 0.81 MEN1 (0.66) ALDH1A1MEN1KMT2AMAPK1ROCK2
SCHEMBL31681385 0.81 MEN1 (0.55) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL5382160 0.81 ACLY (0.56) ALDH1A1MEN1KMT2AMAPK1PIK3CD
SCHEMBL1460972 0.80 MEN1 (0.55) ALDH1A1MEN1KMT2AMAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4643910-B2 2011-03-02 JP claimed
CN-100369899-C Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2008-02-20 CN claimed
JP-2005533004-A 2005-11-04 JP claimed
CN-1642922-A Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2005-07-20 CN 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
CN-100369899-C Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2008-02-20 CN disclosed
CN-1642922-A Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2005-07-20 CN 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 ALDH1A1 2583/4885MEN1 2247/4885KMT2A 1089/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 ALDH1A1 2459/4885MEN1 2443/4885KMT2A 1222/4885

“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.