SCHEMBL9014849

SCHEMBL9014849

Cc1onc(O)c1CCCN

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.34
GRIA1 P42261 1/20 0.33
GRIA3 P42263 1/20 0.33
GAA P10253 1/20 0.30

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
SCHEMBL14759391 0.79 LMNA (0.42) TLR8GAA
SCHEMBL9147234 0.79 GAA (0.32) GRIA1GRIA3GAA
SCHEMBL21940617 0.74
SCHEMBL4437207 0.73 NPSR1 (0.41) GRIA1GRIA3GAA
SCHEMBL3731488 0.71 GRIA1 (0.54) GRIA1GRIA3
Propionic Acid SCHEMBL9538907 0.71 GRIA1 (0.40) GRIA1GRIA3GAA
(R,S)-Ampa SCHEMBL6553747 0.70 GRIA1 (0.56) GRIA1GRIA3
SCHEMBL1580004 0.68 LMNA (0.43) GAA
(S)-Ampa SCHEMBL667915 0.66 GRIA1 (0.69) GRIA1GRIA3
(R,S)-Ampa SCHEMBL2458874 0.66 GRIA1 (0.69) GRIA1GRIA3

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
WO-2019145957-A1 METHOD OF TREATING INTELLECTUAL DISABILITY, AUTISM AND EPILEPSY ASSOCIATED WITH AN IQSEC2 MUTATION AND FOR IDENTIFYING MEDICAMENTS FOR TREATING THE SAME TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2019-08-01 WO disclosed
US-5510367-A TREATMENT OR PREVENTION OF NEUROTOXIC INJURIES SUCH AS CEREBRAL STROKE, HEMMORHAGIC STROKE, CEREBRAL ISCHEMIA, VASOSPASM, HYPOGLYCEMIA, ANAESIA, HYPOXIA, ASHYXIA, CARDIAC ARREST AND NEURODEGENERATIVE DISEASES GLAXO SPA (IT) 1996-04-23 US disclosed