SCHEMBL8007041

SCHEMBL8007041

Oc1ccc(OC[C@@H](O)CN2CCN(c3ccc(Cc4ccccc4)cc3)CC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.71
MAPT P10636 4/20 0.69
HTR7 P34969 2/20 0.67
ALOX15 P16050 1/20 0.66
KMT2A Q03164 5/20 0.65
MAPK1 P28482 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
ALDH1A1 P00352 2/20 0.62
LMNA P02545 1/20 0.62
MEN1 O00255 3/20 0.62
TSHR P16473 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
ABCB1 P08183 3/20 0.60
GAA P10253 1/20 0.60
PRMT5 O14744 1/20 0.59
WDR77 Q9BQA1 1/20 0.59

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
SCHEMBL8009539 0.91 MAPT (0.79) KCNH2MAPTHTR7ALOX15KMT2A
SCHEMBL25097473 0.91 MAPT (0.79) KCNH2MAPTHTR7ALOX15KMT2A
SCHEMBL8002897 0.91 MAPT (0.79) KCNH2MAPTHTR7ALOX15KMT2A
SCHEMBL12576551 0.90 MAPT (0.83) KCNH2MAPTHTR7ALOX15KMT2A
SCHEMBL2016631 0.89 KCNH2 (0.88) KCNH2MAPTHTR7KMT2AMAPK1
SCHEMBL2016634 0.89 KCNH2 (0.88) KCNH2MAPTHTR7KMT2AMAPK1
SCHEMBL2016628 0.89 KCNH2 (0.88) KCNH2MAPTHTR7KMT2AMAPK1
SCHEMBL8002620 0.88 KCNH2 (0.74) KCNH2MAPTHTR7ALOX15KMT2A
SCHEMBL23097675 0.88 KCNH2 (0.74) KCNH2MAPTHTR7ALOX15KMT2A
SCHEMBL25097472 0.86 MEN1 (0.81) KCNH2MAPTHTR7ALOX15KMT2A

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-9079852-B2 NMDA receptor antagonists for neuroprotection EMORY UNIVERSITY (US) 2015-07-14 US disclosed
US-20140031363-A1 NMDA Receptor Antagonists for Neuroprotection LIOTTA DENNIS C (US) 2014-01-30 US disclosed
US-8420680-B2 NMDA receptor antagonists for neuroprotection EMORY UNIVERSITY (US) 2013-04-16 US disclosed
WO-2009137843-A2 NMDA RECEPTOR ANTAGONISTS FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS EMORY UNIVERSITY (US) 2009-11-12 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-20140031363-A1 NMDA Receptor Antagonists for Neuroprotection GRIN1, GRIN2C, GRIK1 KCNH2 135/4885MAPT 2536/4885HTR7 435/4885

“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.