SCHEMBL4649801

SCHEMBL4649801

NC(=O)c1cccc(Nc2nc(Cl)c3nc[nH]c3n2)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 2/20 0.55
CDK2 P24941 1/20 0.48
ROCK1 Q13464 1/20 0.46
SYK P43405 1/20 0.45
AURKA O14965 1/20 0.44
RHOA P61586 1/20 0.44
CDK19 Q9BWU1 1/20 0.43
ALK Q9UM73 1/20 0.43

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
SCHEMBL11309017 0.84 RHOA (0.54) NEK2CDK2ROCK1SYKAURKA
SCHEMBL4649803 0.82 CAMK2D (0.45) CDK2SYK
SCHEMBL4920877 0.79 NEK2 (0.53) NEK2CDK2SYKCDK19ALK
SCHEMBL4919662 0.78 NEK2 (0.48) NEK2CDK2SYKAURKACDK19
SCHEMBL8539781 0.78 MAPK1 (0.50) NEK2CDK2SYKAURKA
SCHEMBL4649832 0.77 PTK2 (0.50) NEK2
SCHEMBL4650371 0.75 PTGS1 (0.43)
SCHEMBL10171951 0.74 IRAK4 (0.63)
SCHEMBL19691014 0.73 POLB (0.44)
SCHEMBL2464073 0.73 SCN9A (0.55) ROCK1SYKAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080261973-A1 Sulphonamidoaniline Derivatives Being Janus Kinase Inhibitors NOVARTIS AG (CH) 2008-10-23 US disclosed
EP-1966210-A2 SULPHONAMIDOANILINE DERIVATIVES BEING JANUS KINASES INHIBITORS Novartis AG (CH) 2008-09-10 EP disclosed
WO-2007071393-A2 SULPHONAMIDOANILINE DERIVATIVES BEING JANUS KINASES INHIBITORS NOVARTIS AG (CH) 2007-06-28 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-20080261973-A1 Sulphonamidoaniline Derivatives Being Janus Kinase Inhibitors GRK4, JAK2, ALK NEK2 609/4885CDK2 252/4885ROCK1 1454/4885

“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.