SCHEMBL589703

SCHEMBL589703

Nc1n[nH]c2ccc(S(=O)(=O)c3cccc(F)c3)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 8/20 0.48
HTR6 P50406 6/20 0.47
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
MAP2K4 P45985 2/20 0.45
JAK3 P52333 2/20 0.44
HTR2A P28223 1/20 0.43
PDPK1 O15530 1/20 0.43
MAP2K7 O14733 1/20 0.42
CDK8 P49336 2/20 0.41
CCNC P24863 1/20 0.41
PRKD3 O94806 2/20 0.41
ROCK1 Q13464 2/20 0.41
CLK4 Q9HAZ1 2/20 0.41
CHEK1 O14757 1/20 0.41
LIMK1 P53667 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
CDC7 O00311 1/20 0.41
PLK4 O00444 1/20 0.41
DAPK3 O43293 1/20 0.41

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
SCHEMBL592519 0.89 JAK2 (0.50) JAK2HTR6MAP2K4JAK3PDPK1
SCHEMBL589733 0.85 JAK2 (0.55) JAK2HTR6JAK3PDPK1CDK8
SCHEMBL1461070 0.81 ITK (0.60) JAK2MAP2K4MAP2K7CDK8PRKD3
SCHEMBL27785430 0.76 CDK2 (0.46) JAK2HTR6JAK3PDPK1CDK8
SCHEMBL590945 0.76 ABCC9 (0.47) HTR6CDK8PRKD3CLK4PLK4
SCHEMBL785649 0.75 JAK2 (0.60) JAK2MAP2K4JAK3HTR2APDPK1
SCHEMBL12907180 0.75 JAK2 (0.71) JAK2JAK3PDPK1PRKD3ROCK1
SCHEMBL4211456 0.75 HTR6 (0.68) HTR6HTR2CHTR2ADYRK1A
SCHEMBL775608 0.74 HTR2C (0.59) HTR6HTR2CHTR2BHTR2A
SCHEMBL11699496 0.74 JAK2 (0.60) JAK2JAK3PDPK1CDK8PRKD3

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
EP-2120932-B1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2014-07-09 EP disclosed
US-8114865-B2 Indazole derivatives as kinase inhibitors for the treatment of cancer NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-02-14 US disclosed
US-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-08-05 US disclosed
EP-2120932-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Nerviano Medical Sciences S.r.l. (IT) 2009-11-25 EP disclosed
WO-2008074749-A9 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2009-05-07 WO disclosed
WO-2008074749-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 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 (1 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-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER MAP3K5, MAP3K19, MAP3K3 JAK2 238/4885HTR6 3756/4885HTR2C 4059/4885

“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.