SCHEMBL19784025

SCHEMBL19784025

O=C(NC(C1CC1)C(F)(F)F)c1cn(-c2ncccc2Cl)c2nc(Cl)ccc2c1=O

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 11/20 0.40
PDE4A P27815 9/20 0.40
P2RX7 Q99572 1/20 0.40
TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL19784026 1.00 KCNH2 (0.40) KCNH2PDE4AP2RX7TRPV1
SCHEMBL19783906 0.92 PDE4A (0.39) KCNH2PDE4AP2RX7
SCHEMBL19783907 0.92 PDE4A (0.39) KCNH2PDE4AP2RX7
SCHEMBL19784186 0.88 TRPV1 (0.36) KCNH2PDE4AP2RX7TRPV1
SCHEMBL19783509 0.87 ULK1 (0.38) KCNH2P2RX7
SCHEMBL19783507 0.87 ULK1 (0.38) KCNH2P2RX7
SCHEMBL19784176 0.86 P2RX7 (0.37) KCNH2PDE4AP2RX7TRPV1
SCHEMBL21220083 0.86 P2RX7 (0.35) KCNH2PDE4AP2RX7TRPV1
SCHEMBL19784175 0.86 P2RX7 (0.35) KCNH2PDE4AP2RX7TRPV1
SCHEMBL18313061 0.85 P2RX7 (0.43) KCNH2PDE4AP2RX7

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 KCNH2 1611/4885PDE4A 793/4885P2RX7 576/4885

“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.