SCHEMBL4914044

SCHEMBL4914044

CN(CCC#N)c1nc(Nc2cccc(NS(C)(=O)=O)c2)nc2[nH]cnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 7/20 0.38
EPHB4 P54760 2/20 0.38
NEK2 P51955 3/20 0.37
TP53 P04637 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
CSNK2A2 P19784 1/20 0.35
LMNA P02545 1/20 0.34
CYP2C9 P11712 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL4920902 0.84 PTK2 (0.42) PTK2EPHB4NEK2TP53CYP1A2
SCHEMBL4917969 0.80 PTK2 (0.39) PTK2EPHB4NEK2JAK1JAK3
SCHEMBL4923439 0.77 PDE5A (0.48) PTK2EPHB4JAK1JAK3BRD4
SCHEMBL4649832 0.76 PTK2 (0.50) PTK2EPHB4NEK2CYP1A2CYP3A4
SCHEMBL4919330 0.75 PDE5A (0.41) PTK2EPHB4NEK2TP53CYP1A2
SCHEMBL4917058 0.74 PTK2 (0.47) PTK2EPHB4NEK2CYP1A2CYP3A4
SCHEMBL4909075 0.73 PDE5A (0.39) PTK2EPHB4NEK2JAK1JAK3
SCHEMBL4917834 0.73 NPC1 (0.46) PTK2EPHB4NEK2CYP1A2CYP3A4
SCHEMBL4914661 0.73 PTK2 (0.43) PTK2EPHB4NEK2JAK1JAK3
SCHEMBL4917306 0.73 PTK2 (0.48) PTK2NEK2TP53CYP1A2CYP3A4

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 1 patent. 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

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 PTK2 1036/4885EPHB4 2337/4885NEK2 609/4885

“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.