SCHEMBL13656229

SCHEMBL13656229

COOSNc1ccc(OCCN2CCN(c3ccc(Cl)c(Cl)c3)CC2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.51
GRIN2B Q13224 2/20 0.51
MAPT P10636 3/20 0.43
KCNH2 Q12809 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.38
RAB9A P51151 2/20 0.38
HTR7 P34969 1/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
BCL2A1 Q16548 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HIF1A Q16665 1/20 0.35
CA2 P00918 1/20 0.35
STS P08842 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL12575980 0.86 GRIN1 (0.56) GRIN1GRIN2BMAPTKCNH2SMN1; SMN2
SCHEMBL13656227 0.86 GRIN1 (0.49) GRIN1GRIN2BMAPTKCNH2SMN1; SMN2
SCHEMBL2019056 0.83 GRIN1 (0.73) GRIN1GRIN2BMAPTKCNH2RAB9A
SCHEMBL13656118 0.76 GRIN1 (0.69) GRIN1GRIN2BMAPTSMN1; SMN2RAB9A
SCHEMBL2016808 0.73 MAOB (0.53) GRIN1GRIN2BKCNH2SMN1; SMN2HTR7
SCHEMBL2021594 0.72 KCNH2 (0.49) MAPTKCNH2HTR7MEN1KMT2A
SCHEMBL13656115 0.72 HTR7 (0.46) GRIN1GRIN2BMAPTSMN1; SMN2RAB9A
SCHEMBL13656297 0.71 GRIN1 (0.67) GRIN1GRIN2BKCNH2
SCHEMBL14864184 0.70 GRIN1 (0.78) GRIN1GRIN2BMAPTKCNH2KDM4E
SCHEMBL13656110 0.70 GRIN1 (0.67) GRIN1GRIN2BMAPTSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420680-B2 NMDA receptor antagonists for neuroprotection EMORY UNIVERSITY (US) 2013-04-16 US disclosed
US-20090253710-A1 NMDA Receptor Antagonists for Neuroprotection EMORY UNIVERSITY 2009-10-08 US 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-20090253710-A1 NMDA Receptor Antagonists for Neuroprotection GRIN1, GRIN2C, GRIK1 GRIN1 1/4885GRIN2B 7/4885MAPT 2477/4885

“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.