SCHEMBL19783910

SCHEMBL19783910

CC[C@@H](NC(=O)c1cn(-c2ncccc2F)c2nc(Cl)ccc2c1=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.42
KCNH2 Q12809 9/20 0.42
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
DHODH Q02127 1/20 0.33
IDH1 O75874 1/20 0.33
IDH2 P48735 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
SCHEMBL19783912 1.00 PDE4A (0.42) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL19784024 0.92 PDE4A (0.42) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL19784023 0.92 PDE4A (0.42) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL20532007 0.88 KMT2A (0.40) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL18313528 0.88 KMT2A (0.42) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL20532036 0.88 KMT2A (0.42) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL18313399 0.88 KMT2A (0.40) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL21440521 0.88 KMT2A (0.40) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL20969353 0.87 GSK3B (0.35) PDE4AKCNH2KMT2AMEN1LMNA
SCHEMBL19784014 0.87 GSK3B (0.35) PDE4AKCNH2KMT2AMEN1LMNA

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 5 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
EP-3481823-A1 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2019-05-15 EP 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 PDE4A 793/4885KCNH2 1611/4885KMT2A 3602/4885

“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.