SCHEMBL5131670

SCHEMBL5131670

CCCCc1nc2ccccn2c(=O)c1-c1ccc(N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)nc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.44
SYK P43405 2/20 0.42
PRMT5 O14744 1/20 0.41
KCNK3 O14649 3/20 0.40
KCNK9 Q9NPC2 3/20 0.40
PIK3CD O00329 2/20 0.40
MET P08581 1/20 0.39
BTK Q06187 1/20 0.38
DDR1 Q08345 2/20 0.38
MERTK Q12866 1/20 0.38
IDH1 O75874 1/20 0.38
CCNT1 O60563 1/20 0.37

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
SCHEMBL5131668 1.00 USP30 (0.44) USP30SYKPRMT5KCNK3KCNK9
SCHEMBL3955479 0.90 KCNK3 (0.42) USP30KCNK3KCNK9METBTK
SCHEMBL3955483 0.90 KCNK3 (0.42) USP30KCNK3KCNK9METBTK
SCHEMBL5131691 0.90 KCNK3 (0.42) USP30KCNK3KCNK9METBTK
SCHEMBL3965077 0.90 SYK (0.40) SYKKCNK3KCNK9
SCHEMBL3961041 0.87 USP30 (0.41) USP30KCNK3KCNK9METBTK
SCHEMBL4233958 0.86 KCNK3 (0.42) USP30KCNK3KCNK9PIK3CDMET
SCHEMBL4233959 0.86 KCNK3 (0.42) USP30KCNK3KCNK9PIK3CDMET
SCHEMBL3965651 0.86 GFER (0.45) USP30KCNK3KCNK9METBTK
SCHEMBL3963510 0.86 GFER (0.45) USP30KCNK3KCNK9METBTK

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
US-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 US claimed
US-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 US disclosed
US-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 US disclosed
US-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 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-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS SCN1A, SCN3A, SCN1B USP30 4715/4885SYK 2126/4885PRMT5 4059/4885

“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.