SCHEMBL403645

SCHEMBL403645

CNC(=O)c1ccc2ncc(C(=O)OC(C)C(=O)O)c(Nc3ccc(OC)cc3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.51
CSF1R P07333 2/20 0.48
NUDT1 P36639 1/20 0.48
MAPT P10636 5/20 0.47
PDE4B Q07343 2/20 0.47
TP53 P04637 3/20 0.46
GAA P10253 2/20 0.46
THRB P10828 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.46
SLC2A1 P11166 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.45
CLK1 P49759 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CREBBP Q92793 1/20 0.45
KDM4E B2RXH2 1/20 0.44
PKM P14618 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
SCHEMBL403225 0.93 PAX8 (0.51) PAX8CSF1RNUDT1MAPTPDE4B
SCHEMBL3657702 0.89 PAX8 (0.57) PAX8CSF1RNUDT1MAPTPDE4B
SCHEMBL401899 0.86 CSF1R (0.55) PAX8CSF1RNUDT1PDE4BGAA
SCHEMBL29744204 0.86 CSF1R (0.55) PAX8CSF1RNUDT1PDE4BGAA
Hydrochloric Acid SCHEMBL15094014 0.86 PAX8 (0.56) PAX8CSF1RNUDT1PDE4BGAA
SCHEMBL403648 0.84 PAX8 (0.68) PAX8MAPTPDE4BTP53GAA
SCHEMBL16414396 0.84 PAX8 (0.49) PAX8CSF1RNUDT1MAPTPDE4B
Hydrochloric Acid SCHEMBL15093957 0.83 PAX8 (0.70) PAX8MAPTPDE4BTP53GAA
SCHEMBL3659497 0.82 PAX8 (0.58) PAX8MAPTTP53GAATHRB
SCHEMBL402202 0.82 PAX8 (0.55) PAX8CSF1RMAPTTP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432764-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS ClanoTech AB (SE) 2012-03-28 EP claimed
US-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2012-03-15 US claimed
WO-2010133669-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2010-11-25 WO claimed
US-9376393-B2 Quinoline compounds which are anti-angiogenic integrin alpha5 beta1 inhibitors for use in the treatment of fibrosis or fibrosis-related diseases CLANOTECH AB (SE) 2016-06-28 US disclosed
US-9376393-B2 Quinoline compounds which are anti-angiogenic integrin alpha5 beta1 inhibitors for use in the treatment of fibrosis or fibrosis-related diseases CLANOTECH AB (SE) 2016-06-28 US disclosed
US-9376393-B2 Quinoline compounds which are anti-angiogenic integrin alpha5 beta1 inhibitors for use in the treatment of fibrosis or fibrosis-related diseases CLANOTECH AB (SE) 2016-06-28 US disclosed
US-20150031723-A1 Quinoline Compounds Which Are Anti-Angiogenic Integrin Alpha5 Beta1 Inhibitors for Use in the Treatment of Fibrosis or Fibrosis-Related Diseases CLANOTECH AB (SE) 2015-01-29 US disclosed
US-20150031723-A1 Quinoline Compounds Which Are Anti-Angiogenic Integrin Alpha5 Beta1 Inhibitors for Use in the Treatment of Fibrosis or Fibrosis-Related Diseases CLANOTECH AB (SE) 2015-01-29 US disclosed
US-20150031723-A1 Quinoline Compounds Which Are Anti-Angiogenic Integrin Alpha5 Beta1 Inhibitors for Use in the Treatment of Fibrosis or Fibrosis-Related Diseases CLANOTECH AB (SE) 2015-01-29 US disclosed
WO-2013103317-A1 QUINOLINE COMPOUNDS WHICH ARE ANTI-ANGIOGENIC INTEGRIN ALPHA5 BETAL INHIBITORS FOR USE IN THE TREATMENT OF FIBROSIS OR FIBROSIS-RELATED DISEASES CLANOTECH AB (SE) 2013-07-11 WO disclosed
EP-2432764-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS ClanoTech AB (SE) 2012-03-28 EP disclosed
US-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2012-03-15 US disclosed
US-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2012-03-15 US disclosed
US-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2012-03-15 US disclosed
WO-2010133669-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2010-11-25 WO disclosed
WO-2010133669-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS CLANOTECH AB (SE) 2010-11-25 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 (2 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-20150031723-A1 Quinoline Compounds Which Are Anti-Angiogenic Integrin Alpha5 Beta1 Inhibitors for Use in the Treatment of Fibrosis or Fibrosis-Related Diseases ITGB5, ITGA5, ITGAL PAX8 381/4885CSF1R 904/4885NUDT1 3611/4885
US-20120065199-A1 SUBSTITUTED QUINOLINES FOR USE AS VEGF INHIBITORS FLT1, FLT4, VEGFA PAX8 1573/4885CSF1R 85/4885NUDT1 2376/4885

“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.