SCHEMBL13337104

SCHEMBL13337104

Cn1nc(-c2ccn3c(I)cnc3c2)oc1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.46
IL2 P60568 2/20 0.35
KDR P35968 7/20 0.34
FGFR3 P22607 2/20 0.34
HDAC8 Q9BY41 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
FLT3 P36888 7/20 0.33
NEK2 P51955 1/20 0.32

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
SCHEMBL3322471 0.75 FGFR3 (0.52) NOTUMKDRFGFR3FLT3
SCHEMBL3324408 0.73 HDAC8 (0.53) KDRHDAC8FLT3NEK2
SCHEMBL13337127 0.72 FLT3 (0.37) KDRFGFR3HDAC8FLT3
SCHEMBL3323660 0.72 HDAC6 (0.40) KDRFGFR3FLT3
SCHEMBL13336964 0.72 ABL1 (0.48) NOTUMKDRFGFR3FLT3
SCHEMBL13337071 0.71 FLT3 (0.38) KDRFGFR3KDM4EALDH1A1GAA
SCHEMBL2285490 0.71 NOTUM (0.54) NOTUMIL2KDM4E
SCHEMBL13336965 0.70 NOTUM (0.41) NOTUMKDRKDM4EALDH1A1
SCHEMBL13337099 0.70 FLT3 (0.42) KDRFGFR3FLT3
SCHEMBL18121825 0.70 NOTUM (0.70) NOTUMIL2KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114941-B1 BICYCLIC HETEROCYCLIC COMPOUNDS AS FGFR INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2015-03-25 EP disclosed
US-8895745-B2 Bicyclic heterocyclic compounds as FGFR inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2014-11-25 US disclosed
US-8895745-B2 Bicyclic heterocyclic compounds as FGFR inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2014-11-25 US disclosed
US-20100120761-A1 Bicyclic Heterocyclic Compounds as FGFR Inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2010-05-13 US disclosed
US-20100120761-A1 Bicyclic Heterocyclic Compounds as FGFR Inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2010-05-13 US disclosed
WO-2008078091-A1 BICYCLIC HETEROCYCLIC COMPOUNDS AS FGFR INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2008-07-03 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-20100120761-A1 Bicyclic Heterocyclic Compounds as FGFR Inhibitors FGFR3, FGFR1, FGFR2 NOTUM 1658/4885IL2 2289/4885KDR 32/4885

“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.