SCHEMBL19784130

SCHEMBL19784130

CC(C)(NC(=O)c1cn(-c2ncc(F)cc2F)c2nc(N3CCOCC3)ccc2c1=O)C(F)(F)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 3/20 0.40
BTK Q06187 1/20 0.40
GAA P10253 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPK8 P45983 3/20 0.36
KIF18A Q8NI77 4/20 0.35
ADORA2A P29274 1/20 0.35
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
NTRK1 P04629 1/20 0.34
ALK Q9UM73 1/20 0.34
KDM4E B2RXH2 1/20 0.34
AKT1 P31749 1/20 0.34
RAF1 P04049 1/20 0.34
BRAF P15056 1/20 0.34
SHMT2 P34897 1/20 0.33

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
SCHEMBL21220058 0.89 BTK (0.34) IMPDH2BTKKMT2ANTRK1KDM4E
SCHEMBL21220041 0.89 KIF18A (0.33) IMPDH2BTKKMT2AKIF18AKDM4E
SCHEMBL21220059 0.88 BTK (0.33) IMPDH2BTKKMT2ANTRK1KDM4E
SCHEMBL19784234 0.87 LMNA (0.33) BTKKMT2ANTRK1KDM4E
SCHEMBL19783606 0.86 BTK (0.38) IMPDH2BTKGAAMEN1KMT2A
SCHEMBL20969324 0.84 LMNA (0.33) MEN1KMT2AMAPK8KDM4E
SCHEMBL19784170 0.84 KMT2A (0.45) BTKMEN1KMT2AMAPK8KCNQ3
SCHEMBL19784195 0.84 MEN1 (0.39) IMPDH2BTKGAAMEN1KMT2A
SCHEMBL21238304 0.84 MEN1 (0.39) IMPDH2BTKGAAMEN1KMT2A
SCHEMBL21220068 0.83 NTRK1 (0.41) NTRK1

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 3 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
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 IMPDH2 1526/4885BTK 3556/4885GAA 374/4885

“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.