SCHEMBL19784213

SCHEMBL19784213

CC[C@H](NC(=O)c1cn(-c2ncc(F)cc2F)c2nc(N3CCCN(CCO)C3=O)ccc2c1=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 8/20 0.33
NTRK1 P04629 8/20 0.33
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
KDM4E B2RXH2 1/20 0.31
HTR3A P46098 2/20 0.30

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
SCHEMBL19784220 1.00 JAK2 (0.33) JAK2NTRK1GSK3BDYRK1AKDM4E
SCHEMBL19784111 0.96 GSK3B (0.33) JAK2NTRK1GSK3BDYRK1AKDM4E
SCHEMBL19784108 0.96 GSK3B (0.33) JAK2NTRK1GSK3BDYRK1AKDM4E
SCHEMBL22590991 0.94 GSK3B (0.32) JAK2NTRK1GSK3BDYRK1AKDM4E
SCHEMBL20969345 0.91 JAK2 (0.33) JAK2NTRK1
SCHEMBL20969346 0.91 JAK2 (0.33) JAK2NTRK1
SCHEMBL19784114 0.91 JAK2 (0.33) JAK2NTRK1
SCHEMBL20531868 0.90 JAK2 (0.33) JAK2NTRK1GSK3BDYRK1AKDM4E
SCHEMBL18312982 0.90 JAK2 (0.33) JAK2NTRK1GSK3BDYRK1AKDM4E
SCHEMBL19783578 0.89 JAK2 (0.32) JAK2NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3481823-B1 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF Bayer Pharma AG (DE) 2020-10-28 EP disclosed
US-20190241562-A1 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-08-08 US disclosed
US-20190241562-A1 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-08-08 US disclosed
WO-2018011017-A1 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-01-18 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-20190241562-A1 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF GLS, TNNI3, AADAC JAK2 3495/4885NTRK1 1414/4885GSK3B 3455/4885

“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.