SCHEMBL3958412

SCHEMBL3958412

Cc1nc2ccccn2c(=O)c1-c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.62
KMT2A Q03164 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 2/20 0.51
KDM4E B2RXH2 7/20 0.50
HSD17B10 Q99714 1/20 0.50
HTT P42858 2/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 5/20 0.46
GAA P10253 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 2/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 2/20 0.44
BRD4 O60885 1/20 0.44
CDK2 P24941 1/20 0.44
CASP1 P29466 1/20 0.43

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
SCHEMBL3960302 0.82 ENPP2 (0.52) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3964209 0.82 ENPP2 (0.55) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3962874 0.82 ENPP2 (0.52) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3959106 0.80 ENPP2 (0.50) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3959071 0.80 FADS1 (0.48) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3960626 0.79 USP7 (0.53) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3955434 0.78 MAPT (0.53) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3955336 0.78 ENPP2 (0.48) ENPP2KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL3961043 0.78 ALDH1A1 (0.60) ENPP2KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL3955424 0.77 ENPP2 (0.47) ENPP2KMT2ASMN1; SMN2NPC1RAB9A

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 7 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
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
WO-2008097991-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 WO 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 ENPP2 564/4885KMT2A 3431/4885SMN1; SMN2 108/4885

“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.