SCHEMBL3657702

SCHEMBL3657702

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.57
CSF1R P07333 1/20 0.55
NUDT1 P36639 1/20 0.53
PDE4B Q07343 2/20 0.52
TP53 P04637 3/20 0.52
MAPT P10636 6/20 0.51
GAA P10253 2/20 0.51
THRB P10828 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 1/20 0.51
SLC2A1 P11166 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
HTT P42858 1/20 0.50
CLK1 P49759 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CREBBP Q92793 1/20 0.50
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL29744204 0.92 CSF1R (0.55) PAX8CSF1RNUDT1PDE4BGAA
SCHEMBL401899 0.92 CSF1R (0.55) PAX8CSF1RNUDT1PDE4BGAA
SCHEMBL403648 0.91 PAX8 (0.68) PAX8PDE4BTP53MAPTGAA
Hydrochloric Acid SCHEMBL15094014 0.91 PAX8 (0.56) PAX8CSF1RNUDT1PDE4BGAA
Hydrochloric Acid SCHEMBL15093957 0.90 PAX8 (0.70) PAX8PDE4BTP53MAPTGAA
SCHEMBL403225 0.89 PAX8 (0.51) PAX8CSF1RNUDT1PDE4BTP53
SCHEMBL403645 0.89 PAX8 (0.51) PAX8CSF1RNUDT1PDE4BTP53
SCHEMBL3659497 0.89 PAX8 (0.58) PAX8TP53MAPTGAATHRB
SCHEMBL402202 0.89 PAX8 (0.55) PAX8CSF1RTP53MAPTGAA
SCHEMBL402967 0.87 PAX8 (0.54) PAX8CSF1RPDE4BTP53MAPT

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 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-8957092-B2 Quinoline derivatives and their use as tyrosine kinase inhibitors CLANOTECH AB (SE) 2015-02-17 US disclosed
US-8957092-B2 Quinoline derivatives and their use as tyrosine kinase inhibitors CLANOTECH AB (SE) 2015-02-17 US disclosed
US-8957092-B2 Quinoline derivatives and their use as tyrosine kinase inhibitors CLANOTECH AB (SE) 2015-02-17 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
US-8557843-B2 Quinoline derivatives and their use as tyrosine kinase inhibitors CLANOTECH AB (SE) 2013-10-15 US disclosed
US-8557843-B2 Quinoline derivatives and their use as tyrosine kinase inhibitors CLANOTECH AB (SE) 2013-10-15 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
US-20110053976-A1 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2011-03-03 US disclosed
US-20110053976-A1 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2011-03-03 US disclosed
US-20110053976-A1 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2011-03-03 US disclosed
EP-2220047-A2 COMPOUNDS AND METHODS ClanoTech AB (SE) 2010-08-25 EP disclosed
WO-2009063070-A2 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2009-05-22 WO disclosed
WO-2009063070-A2 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2009-05-22 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-20110053976-A1 QUINOLINE DERIVATIVES AND THEIR USE AS TYROSINE KINASE INHIBITORS BRAF, MAP3K1, MAP3K7 PAX8 3030/4885CSF1R 465/4885NUDT1 2723/4885
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

“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.