SCHEMBL6733709

SCHEMBL6733709

O=[N+]([O-])c1ccc(Oc2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.66
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
RAB9A P51151 2/20 0.60
NPC1 O15118 1/20 0.60
ATM Q13315 1/20 0.60
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA7 P43166 1/20 0.60
CA9 Q16790 1/20 0.60
MAOB P27338 1/20 0.58
PLA2G4B P0C869 1/20 0.57
LMNA P02545 1/20 0.56
CYP19A1 P11511 1/20 0.55
CTSV O60911 1/20 0.55
CTSL P07711 1/20 0.55
HTT P42858 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55

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
SCHEMBL2081746 0.95 MAPT (0.71) MAPTMEN1KMT2ARAB9ACA12
SCHEMBL13192707 0.90 MAOB (0.57) MAPTMEN1KMT2ARAB9AMAOB
SCHEMBL227098 0.88 MAPT (0.71) MAPTMEN1KMT2ARAB9ACA12
Acetonitrile SCHEMBL27544819 0.86 MAPT (0.61) MAPTMEN1KMT2ACA12CA1
SCHEMBL8721905 0.86 MEN1 (0.64) MAPTMEN1KMT2AATMCA12
SCHEMBL1180655 0.86 MAPT (0.69) MAPTMEN1KMT2ACA12CA1
SCHEMBL6730910 0.86 PPIA (0.55) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL28621039 0.86 CA12 (0.76) MAPTMEN1KMT2ARAB9ACA12
SCHEMBL1547274 0.84 HSPB1 (0.63) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL457863 0.82 HSPB1 (0.68) MAPTMEN1KMT2ARAB9ANPC1

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-6800651-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-10-05 US disclosed
US-20040006114-A1 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-01-08 US disclosed
EP-1255735-A2 PYRIDINE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2002-11-13 EP disclosed
WO-2001056990-A2 PYRIDINE DERIVATES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2001-08-09 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-20040006114-A1 Potentiators of glutamate receptors GRM1, GRIN1, GRM2 MAPT 3885/4885MEN1 2793/4885KMT2A 3440/4885

“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.