SCHEMBL3785960

SCHEMBL3785960

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

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.52
EGFR P00533 4/20 0.52
CSF1R P07333 1/20 0.51
MAPT P10636 3/20 0.50
NUDT1 P36639 3/20 0.49
MELK Q14680 1/20 0.48
MAPKAPK2 P49137 1/20 0.45
CREBBP Q92793 1/20 0.45
PHLPP2 Q6ZVD8 1/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
TP53 P04637 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
SCHEMBL3659264 0.90 PAX8 (0.55) PAX8EGFRCSF1RMAPTNUDT1
SCHEMBL3792946 0.90 NUDT1 (0.60) PAX8EGFRCSF1RNUDT1CREBBP
SCHEMBL3786537 0.89 PAX8 (0.50) PAX8EGFRMAPTNUDT1MELK
SCHEMBL403679 0.89 PAX8 (0.52) PAX8EGFRCSF1RNUDT1CREBBP
SCHEMBL401899 0.87 CSF1R (0.55) PAX8EGFRCSF1RNUDT1CREBBP
SCHEMBL29744204 0.87 CSF1R (0.55) PAX8EGFRCSF1RNUDT1CREBBP
SCHEMBL13082917 0.86 EGFR (0.61) PAX8EGFRCSF1RMAPTMELK
Hydrochloric Acid SCHEMBL15094014 0.86 PAX8 (0.56) PAX8EGFRCSF1RNUDT1CREBBP
SCHEMBL3790489 0.86 MAPT (0.71) PAX8MAPTCREBBPGAAKDM4E
SCHEMBL23589718 0.84 NUDT1 (0.68) PAX8CSF1RNUDT1CREBBPKDM4E

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 10 patents. 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
WO-2010133672-A1 DERIVATIVES OF QUINOLINE-3-CARBOXYLIC ACID AND THEIR MEDICAL USE 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-2010133672-A1 DERIVATIVES OF QUINOLINE-3-CARBOXYLIC ACID AND THEIR MEDICAL USE 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 (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-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 381/4885EGFR 3274/4885CSF1R 904/4885

“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.