SCHEMBL4484148

SCHEMBL4484148

CCCCc1cc2c[nH]c(=O)nc2o1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.40
MAPT P10636 2/20 0.40
HCAR2 Q8TDS4 4/20 0.35
ALOX15 P16050 1/20 0.33
ELANE P08246 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PBRM1 Q86U86 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
DAO P14920 1/20 0.32
FFAR3 O14843 1/20 0.31
HCAR3 P49019 1/20 0.31

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
SCHEMBL5452446 0.94 MAPT (0.48) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL5462417 0.94 MAPT (0.48) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL5459808 0.94 MAPT (0.48) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL17082596 0.87 MAPT (0.42) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL17082572 0.87 MAPT (0.40) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL17082582 0.87 MAPT (0.42) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL14645434 0.87 MAPT (0.42) TLR8MAPTHCAR2ALOX15ELANE
SCHEMBL22282116 0.72 NQO1 (0.37) SMN1; SMN2
SCHEMBL5460105 0.69 MAPT (0.40) TLR8MAPTALOX15SMN1; SMN2
SCHEMBL5451435 0.68 TLR8 (0.36) TLR8MAPTHCAR2ALOX15

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-7501429-B2 Pyrimidine compounds as anti-ictogenic and/or anti-epileptogenic agents QUEEN'S UNIVERSITY AT KINGSTON (CA) 2009-03-10 US disclosed
US-7501429-B2 Pyrimidine compounds as anti-ictogenic and/or anti-epileptogenic agents QUEEN'S UNIVERSITY AT KINGSTON (CA) 2009-03-10 US disclosed
US-7501429-B2 Pyrimidine compounds as anti-ictogenic and/or anti-epileptogenic agents QUEEN'S UNIVERSITY AT KINGSTON (CA) 2009-03-10 US disclosed
US-20070191373-A1 Heterocyclic compounds for use in the treatment of viral infections REGAN FOUNDATION (BE) 2007-08-16 US disclosed
EP-1385831-A2 PYRIMIDINE COMPOUNDS AS ANTI-ICTOGENIC AND/OR ANTI-EPILEPTOGENIC AGENTS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2004-02-04 EP disclosed
US-20030153584-A1 Pyrimidine compounds as anti-ictogenic and/or anti-epileptogenic agents QUEEN'S UNIVERSITY (CA) 2003-08-14 US disclosed
WO-2002083651-A2 PYRIMIDINE COMPOUNDS AS ANTI-ICTOGENIC AND/OR ANTI-EPILEPTOGENIC AGENTS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2002-10-24 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 (2 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-20030153584-A1 Pyrimidine compounds as anti-ictogenic and/or anti-epileptogenic agents NUDT1, DPYD, TYMP TLR8 4564/4885MAPT 1146/4885HCAR2 212/4885
US-20070191373-A1 Heterocyclic compounds for use in the treatment of viral infections TPMT, TYMP, HAVCR2 TLR8 108/4885MAPT 3202/4885HCAR2 1237/4885

“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.