SCHEMBL16668121

SCHEMBL16668121

CO[13CH](OC)c1ccc2c(n1)NCCO2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GRM5 P41594 2/20 0.36
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
ITGB3 P05106 2/20 0.33
ITGAV P06756 2/20 0.33
ITGB1 P05556 1/20 0.33
ITGA5 P08648 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADRA2A P08913 2/20 0.32
ADRA2C P18825 2/20 0.32
ADRA1D P25100 2/20 0.32
ADRA1A P35348 2/20 0.32
ADRA1B P35368 2/20 0.32
ADRA2B P18089 1/20 0.32
FABP6 P51161 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31

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
SCHEMBL16668453 1.00 ALDH1A1 (0.37) ALDH1A1MAPTGAAHSD17B10GRM5
SCHEMBL13340897 0.83 ALDH1A1 (0.40) ALDH1A1MAPTGAAHSD17B10GRM5
SCHEMBL28728264 0.74 SMN1; SMN2 (0.33) ALDH1A1MAPTSMN1; SMN2L3MBTL1POLB
SCHEMBL325378 0.74 CXCR4 (0.39) ITGB3ITGAV
SCHEMBL21281617 0.74 JAK2 (0.35) ALDH1A1MAPTGAAHSD17B10ADRA2A
SCHEMBL2492111 0.74 GAA (0.47) ALDH1A1MAPTGAAHSD17B10GRM5
SCHEMBL23530203 0.74 MAPK1 (0.40) ALDH1A1MAPTGAAHSD17B10GRM5
SCHEMBL29550457 0.74 MAPK1 (0.40) ALDH1A1MAPTGAAHSD17B10GRM5
SCHEMBL16668608 0.73 CXCR4 (0.36) ITGB3ITGAV
SCHEMBL6261283 0.72 JAK2 (0.34) ALDH1A1MAPTGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3060563-B1 RING-FUSED BICYCLIC PYRIDYL DERIVATIVES AS FGFR4 INHIBITORS NOVARTIS AG (CH) 2018-05-02 EP disclosed
US-9896449-B2 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors NOVARTIS AG (CH) 2018-02-20 US disclosed
US-20170066766-A1 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors NOVARTIS AG (CH) 2017-03-09 US disclosed
US-9533988-B2 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors NOVARTIS AG (CH) 2017-01-03 US disclosed
EP-3060563-A1 RING-FUSED BICYCLIC PYRIDYL DERIVATIVES AS FGFR4 INHIBITORS Novartis AG (CH) 2016-08-31 EP disclosed
US-20160102092-A1 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors NOVARTIS AG (CH) 2016-04-14 US disclosed
US-9266883-B2 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors NOVARTIS AG (CH) 2016-02-23 US disclosed
US-20150119385-A1 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors NOVARTIS AG (CH) 2015-04-30 US disclosed
WO-2015059668-A1 RING-FUSED BICYCLIC PYRIDYL DERIVATIVES AS FGFR4 INHIBITORS NOVARTIS AG (CH) 2015-04-30 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 (3 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-20150119385-A1 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors FGFR4, FGFR1, FGFR3 ALDH1A1 1151/4885MAPT 1361/4885GAA 2770/4885
US-20160102092-A1 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors FGFR4, FGFR1, FGFR3 ALDH1A1 1151/4885MAPT 1361/4885GAA 2770/4885
US-20170066766-A1 Ring-fused bicyclic pyridyl derivatives as FGFR4 inhibitors FGFR4, FGFR1, FGFR3 ALDH1A1 1151/4885MAPT 1361/4885GAA 2770/4885

“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.