SCHEMBL26529054

SCHEMBL26529054

CC(F)(F)COc1ncc(-c2ccc(=O)n(Cc3cccnc3)n2)cn1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 12/20 0.46
▸ PDE4A P27815 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ HDAC1 Q13547 1/20 0.40
▸ IRAK4 Q9NWZ3 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ IRAK1 P51617 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL29569904 0.92 MET (0.45) METPDE4APDE4BPDE4CPDE4D
SCHEMBL23559023 0.92 MET (0.45) METPDE4APDE4BPDE4CPDE4D
SCHEMBL26529105 0.87 MET (0.40) METPDE4APDE4BPDE4CPDE4D
SCHEMBL26999063 0.86 MET (0.52) METPDE4APDE4BPDE4CPDE4D
SCHEMBL29569490 0.85 MET (0.43) METPDE4APDE4BPDE4CPDE4D
SCHEMBL23528280 0.85 MET (0.43) METPDE4APDE4BPDE4CPDE4D
SCHEMBL26530932 0.85 MET (0.43) METPDE4APDE4BPDE4CPDE4D
SCHEMBL26528983 0.84 GRIN1 (0.42) METPDE4APDE4BPDE4CPDE4D
SCHEMBL26625219 0.81 PDE4A (0.50) METPDE4APDE4BPDE4CPDE4D
SCHEMBL26529033 0.81 MAPT (0.38) METPDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230321091-A1 SUBSTITUTED PYRIDAZINONES FOR USE IN THE TREATMENT OF NEUROMUSCULAR DISEASES EDGEWISE THERAPEUTICS, INC. 2023-10-12 — — US 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-20230321091-A1 SUBSTITUTED PYRIDAZINONES FOR USE IN THE TREATMENT OF NEUROMUSCULAR DISEASES IL6, MUSK, SMN1; SMN2 MET 4319/4885PDE4A 305/4885PDE4B 618/4885

“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.

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