SCHEMBL4867404

SCHEMBL4867404

O=C(O)Cc1nc(NCc2ccccn2)c2c(-c3ccccc3)coc2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 14/20 0.47
KCNA5 P22460 11/20 0.47
JAK2 O60674 2/20 0.47
CDK2 P24941 2/20 0.47
TYK2 P29597 2/20 0.47
GSK3B P49841 2/20 0.47
JAK3 P52333 2/20 0.47
BTK Q06187 2/20 0.47
AURKB Q96GD4 2/20 0.47
IRAK4 Q9NWZ3 2/20 0.47
IGF1R P08069 1/20 0.47
PIM1 P11309 1/20 0.47
SRC P12931 1/20 0.47
CSNK2A2 P19784 1/20 0.47
JAK1 P23458 1/20 0.47
CCNE1 P24864 1/20 0.47
FLT4 P35916 1/20 0.47
FLT3 P36888 1/20 0.47
MAP3K8 P41279 1/20 0.47
CSNK1A1 P48729 1/20 0.47

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
SCHEMBL5242498 0.95 KCNH2 (0.43) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4865901 0.80 KCNH2 (0.49) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4863471 0.80 CDK2 (0.50) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4860362 0.79 KCNH2 (0.51) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4869478 0.78 TNF (0.61) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4864910 0.76 PIK3CA (0.52) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4862847 0.76 KCNA5 (0.48) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4867940 0.72 KCNA5 (0.47) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL2368488 0.71 TNF (0.59) KCNH2KCNA5JAK2CDK2TYK2
SCHEMBL4869591 0.70 KCNA5 (0.52) KCNH2KCNA5JAK2CDK2TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456187-B2 Furanopyrimidine compounds as potassium ion channel inhibitors XENTION LIMITED (GB) 2008-11-25 US disclosed
US-20050282829-A1 Furanopyrimidine compounds as potassium ion channel inhibitors XENTION DISCOVERY LTD. (GB) 2005-12-22 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-20050282829-A1 Furanopyrimidine compounds as potassium ion channel inhibitors KCNH3, HCN4, KCNH2 KCNH2 3/4885KCNA5 6/4885JAK2 3645/4885

“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.