SCHEMBL4008607

SCHEMBL4008607

CS(=O)(=O)Nc1ccc2[nH]ncc2c1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.67
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
ROCK2 O75116 11/20 0.59
ROCK1 Q13464 4/20 0.59
NPC1 O15118 1/20 0.50
JAK2 O60674 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 1/20 0.50
NOS1 P29475 1/20 0.50
MAPKAPK2 P49137 1/20 0.49

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
SCHEMBL1460530 0.81 MEN1 (0.73) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL10586698 0.80 MEN1 (0.61) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL1460717 0.79 ALDH1A1 (0.80) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL20023283 0.79 ROCK2 (0.82) ROCK2ROCK1
SCHEMBL10179696 0.78 TMEM97 (0.52) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL6532132 0.78 CYP1A2 (0.67) MAPK1ROCK2ROCK1NPC1JAK2
SCHEMBL6089128 0.78 MEN1 (0.60) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL2569041 0.78 ROCK2 (0.63) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL2845149 0.77 MEN1 (0.65) MAPK1MEN1KMT2AROCK2ROCK1
SCHEMBL12059977 0.76 CYP19A1 (0.64) MAPK1MEN1KMT2AROCK2ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 US 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 MAPK1 396/4885MEN1 2247/4885KMT2A 1089/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 MAPK1 418/4885MEN1 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.