SCHEMBL2215854

SCHEMBL2215854

O=C(ONC1CC1c1ccc(Br)cc1)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.43
MAOB P27338 7/20 0.43
MAOA P21397 4/20 0.43
TLR2 O60603 1/20 0.42
TLR1 Q15399 1/20 0.42
KCNH2 Q12809 2/20 0.38
RCOR1 Q9UKL0 2/20 0.38
KDM1B Q8NB78 1/20 0.38
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
SLC6A2 P23975 1/20 0.36

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
SCHEMBL27908161 0.86 KDM1A (0.46) KDM1AMAOBMAOATLR2TLR1
SCHEMBL15212170 0.81 KDM1A (0.45) KDM1AMAOBMAOAKCNH2SLC6A4
SCHEMBL3045300 0.77 KDM1A (0.41) KDM1AMAOBMAOA
SCHEMBL15554113 0.76 SLC9A1 (0.42) KDM1ASLC6A3SLC6A2
SCHEMBL27991097 0.75 KDM1A (0.54) KDM1AMAOBMAOA
SCHEMBL27908354 0.72 KDM1A (0.41) KDM1AMAOBMAOA
SCHEMBL15540596 0.72 HTR2A (0.40) KCNH2
SCHEMBL27898196 0.71 KDM1A (0.40) KDM1AMAOBMAOA
SCHEMBL27898192 0.70 KDM1A (0.40) KDM1AMAOBMAOATLR2TLR1
SCHEMBL15552976 0.70 CFD (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1848695-B1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LTD (GB) 2011-07-27 EP disclosed
US-7790758-B2 glutamate receptors agonists; especially to treat psychotic conditions, including schizophrenia and enhancement of cognition; N-{-2-[4-(6-fluoro-3-pyridinyl)phenyl]cyclopropyl}-2-propanesulfonamide; stereoselectively epoxidising a suitable styrene; coupling with boronic acid derivatives GLAXO GROUP LIMITED (GB) 2010-09-07 US disclosed
US-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GLAXO GROUP LIMITED (GB) 2008-07-10 US disclosed
EP-1848695-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-10-31 EP disclosed
WO-2006087169-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2006-08-24 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 (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-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GRIN1, GRM2, GRM1 KDM1A 3326/4885MAOB 1930/4885MAOA 2383/4885

“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.