SCHEMBL4909998

SCHEMBL4909998

CS(=O)(=O)Nc1cccc(Nc2nc(NCc3ccc4nonc4c3)c3nc[nH]c3n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 9/20 0.39
CYP3A4 P08684 9/20 0.39
CYP2D6 P10635 8/20 0.39
CYP2C19 P33261 8/20 0.39
USP2 O75604 6/20 0.39
TSHR P16473 6/20 0.39
ALDH1A1 P00352 6/20 0.39
CYP2C9 P11712 6/20 0.39
KDM4E B2RXH2 5/20 0.39
MAPT P10636 4/20 0.39
MAPK1 P28482 4/20 0.39
HPGD P15428 4/20 0.39
MEN1 O00255 3/20 0.39
LMNA P02545 3/20 0.39
KMT2A Q03164 3/20 0.39
HIF1A Q16665 2/20 0.39
RAF1 P04049 1/20 0.39
HSD17B10 Q99714 5/20 0.38
TP53 P04637 2/20 0.38
CLK4 Q9HAZ1 1/20 0.38

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
SCHEMBL4914819 0.88 PDE5A (0.44) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4916374 0.86 PDE5A (0.50) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4919702 0.84 PDE5A (0.42) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4909992 0.84 PDE5A (0.43) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4912787 0.84 PTK2 (0.51) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4922248 0.83 PTK2 (0.43) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4917738 0.83 MAPT (0.46) TSHRALDH1A1MAPTMAPK1MEN1
SCHEMBL4917319 0.83 PTK2 (0.45) PDE5APTK2
SCHEMBL4919330 0.83 PDE5A (0.41) CYP1A2CYP3A4CYP2D6CYP2C19USP2
SCHEMBL4920844 0.82 CYP1A2 (0.55) CYP1A2CYP3A4CYP2D6CYP2C19USP2

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 CYP1A2 1961/4885CYP3A4 667/4885CYP2D6 2215/4885

“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.