SCHEMBL4528392

SCHEMBL4528392

O=C(c1cc(=O)c2ccc(OCc3ccccc3)cc2[nH]1)N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 4/20 0.63
GRIN3B O60391 4/20 0.63
GRIN1 Q05586 4/20 0.63
GRIN2A Q12879 4/20 0.63
GRIN2B Q13224 4/20 0.63
GRIN2C Q14957 4/20 0.63
GRIN3A Q8TCU5 4/20 0.63
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
NPC1 O15118 1/20 0.63
MAPT P10636 1/20 0.60
LTB4R Q15722 1/20 0.56
LTB4R2 Q9NPC1 1/20 0.56

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
SCHEMBL7177174 0.88 MEN1 (0.80) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7167916 0.86 GRIN2D (0.66) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4520373 0.82 GRIN2D (0.76) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7154105 0.79 MEN1 (0.80) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4523117 0.79 HPGD (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4515245 0.78 GRIN2D (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7155416 0.78 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7167795 0.78 MEN1 (0.76) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9785782 0.77 LTB4R (0.64) MEN1KMT2ALTB4RLTB4R2
SCHEMBL11981504 0.77 AKR1C3 (0.67) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012118-A1 Kynurenic Acid Amide Derivatives as Nr2b Receptor Antagoni RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2009-01-08 US disclosed
EP-1771436-A1 KYNURENIC ACID AMIDE DERIVATIVES AS NR2B RECEPTOR ANTAGONISTS Richter Gedeon Vegy Szeti Gy R Rt. (HU) 2007-04-11 EP disclosed
WO-2006010967-A1 KYNURENIC ACID AMIDE DERIVATIVES AS NR2B RECEPTOR ANTAGONISTS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2006-02-02 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-20090012118-A1 Kynurenic Acid Amide Derivatives as Nr2b Receptor Antagoni GRIN1, GRIN2A, GRIN2B GRIN2D 5/4885GRIN3B 8/4885GRIN1 1/4885

“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.