SCHEMBL3955475

SCHEMBL3955475

CCCCc1nc2ccc(F)cn2c(=O)c1-c1ccc(NC2CCNC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AXL P30530 7/20 0.37
MET P08581 1/20 0.37
FADS1 O60427 2/20 0.35
ENPP2 Q13822 2/20 0.34
HRH4 Q9H3N8 1/20 0.34
TYRO3 Q06418 4/20 0.34
MERTK Q12866 4/20 0.34
FLT3 P36888 3/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
CHEK1 O14757 2/20 0.33
KHK P50053 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
PRKCI P41743 1/20 0.32

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
SCHEMBL3955467 1.00 AXL (0.37) AXLMETFADS1ENPP2HRH4
Hydrochloric Acid SCHEMBL5128633 0.99 AXL (0.36) AXLMETFADS1ENPP2HRH4
Hydrochloric Acid SCHEMBL5128628 0.99 AXL (0.36) AXLMETFADS1ENPP2HRH4
SCHEMBL3955443 0.90 AXL (0.37) AXLMETFADS1TYRO3MERTK
SCHEMBL3955446 0.90 AXL (0.37) AXLMETFADS1TYRO3MERTK
Hydrochloric Acid SCHEMBL3963592 0.90 AXL (0.37) AXLMETFADS1TYRO3MERTK
Hydrochloric Acid SCHEMBL3963588 0.90 AXL (0.37) AXLMETFADS1TYRO3MERTK
SCHEMBL3957545 0.86 MAPT (0.42) AXLKHK
SCHEMBL3961228 0.86 MAPT (0.42) AXLKHK
SCHEMBL3964249 0.86 MAPT (0.42) AXLKHK

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
EP-2079737-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2009-07-22 EP disclosed
US-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 US disclosed
WO-2008097991-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 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-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS SCN1A, SCN3A, SCN1B AXL 4584/4885MET 4091/4885FADS1 2036/4885

“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.