SCHEMBL4916441

SCHEMBL4916441

CS(=O)(=O)Nc1cccc(Nc2nc(N3CCNCC34CCCCC4)c3nc[nH]c3n2)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 6/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CG P48736 1/20 0.38
MARK3 P27448 2/20 0.37
MARK4 Q96L34 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
JAK2 O60674 5/20 0.36
JAK3 P52333 5/20 0.36
BRD4 O60885 1/20 0.36
CHEK1 O14757 2/20 0.35
BMPR2 Q13873 1/20 0.35
EPHB4 P54760 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
SCHEMBL4917022 0.81 PIK3CA (0.46) PTK2PIK3CAPIK3CGCYP1A2CYP2D6
SCHEMBL4917865 0.81 PTK2 (0.38) PTK2PIK3CAPIK3CGMARK3MARK4
SCHEMBL4919616 0.79 PIK3CA (0.57) PTK2PIK3CAPIK3CGCYP1A2USP2
SCHEMBL4914681 0.78 BRD4 (0.53) PTK2PIK3CAPIK3CGCYP1A2CYP2D6
SCHEMBL4920489 0.75 BRD4 (0.48) PTK2PIK3CAPIK3CGCYP1A2CYP3A4
SCHEMBL4917631 0.74 PTK2 (0.47) PTK2PIK3CAPIK3CGJAK2JAK3
SCHEMBL4917337 0.74 PTK2 (0.40) PTK2PIK3CAPIK3CGCYP1A2CYP2D6
SCHEMBL4916439 0.74 ADORA3 (0.42) PTK2PIK3CAPIK3CGJAK2JAK3
SCHEMBL4916388 0.74 ADORA3 (0.42) PTK2PIK3CAPIK3CGJAK2JAK3
SCHEMBL4649832 0.73 PTK2 (0.50) PTK2CYP1A2CYP2D6USP2CYP3A4

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 1036/4885PIK3CA 635/4885PIK3CG 1751/4885

“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.