SCHEMBL3323671

SCHEMBL3323671

CS(=O)(=O)Nc1cccc(-c2cnc3cc(-c4cccc(CN5CCOCC5)c4)ccn23)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.54
JAK2 O60674 2/20 0.52
JAK3 P52333 2/20 0.52
CYP1A2 P05177 3/20 0.51
CYP3A4 P08684 3/20 0.51
USP2 O75604 2/20 0.51
CLK4 Q9HAZ1 2/20 0.51
ALDH1A1 P00352 1/20 0.51
FYN P06241 3/20 0.50
CHEK1 O14757 1/20 0.47
MAPK1 P28482 2/20 0.47
LMNA P02545 1/20 0.47
HIF1A Q16665 1/20 0.47
FGFR3 P22607 6/20 0.46
PIK3CA P42336 1/20 0.45
MTOR P42345 1/20 0.45
PTK2 Q05397 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL3323936 0.88 KDR (0.53) KDRFYNFGFR3
SCHEMBL3585427 0.87 KDR (0.49) KDRCHEK1FGFR3
SCHEMBL13336644 0.85 FGFR3 (0.66) KDRFGFR3
SCHEMBL13407715 0.83 FGFR3 (0.45) KDRCHEK1FGFR3
SCHEMBL3322545 0.83 CHEK1 (0.52) KDRCHEK1
Formic Acid SCHEMBL3323375 0.83 FGFR3 (0.63) KDRFGFR3
SCHEMBL13336412 0.82 KDR (0.47) KDRALDH1A1CHEK1FGFR3
SCHEMBL17157045 0.81 KDR (0.43) KDRCHEK1FGFR3
SCHEMBL13336640 0.81 KDR (0.61) KDRFYNFGFR3
SCHEMBL13407685 0.81 KDR (0.49) KDRCHEK1FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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 KDR 32/4885JAK2 17/4885JAK3 106/4885

“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.