SCHEMBL7361750

SCHEMBL7361750

O=C(O)c1ccc2c(c1)no[n+]2[O-].O=C(c1ccc2c(c1)no[n+]2[O-])N1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.71
CA2 P00918 3/20 0.71
CA9 Q16790 3/20 0.71
MAPT P10636 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
GRIA3 P42263 1/20 0.54
GRIA4 P48058 1/20 0.54
HPGD P15428 8/20 0.49
OPRK1 P41145 1/20 0.46
SMYD3 Q9H7B4 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
HDAC1 Q13547 4/20 0.44
HDAC2 Q92769 4/20 0.44
ALDH1A1 P00352 1/20 0.44
CA1 P00915 2/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL5757808 0.95 MAPT (0.63) CA12CA2CA9MAPTNPSR1
SCHEMBL548486 0.84 CA12 (1.00) CA12CA2CA9SMYD3HDAC1
SCHEMBL7370172 0.82 CA12 (0.58) CA12CA2CA9MAPTNPSR1
Ethylene SCHEMBL8378460 0.82 CA12 (0.58) CA12CA2CA9MAPTNPSR1
SCHEMBL7559546 0.79 CA12 (0.56) CA12CA2CA9MAPTNPSR1
SCHEMBL7555952 0.77 CA12 (0.54) CA12CA2CA9MAPTNPSR1
SCHEMBL10576406 0.72 CA12 (0.74) CA12CA2CA9MAPTNPSR1
SCHEMBL3282985 0.72 CA12 (0.74) CA12CA2CA9SMYD3HDAC1
SCHEMBL5760125 0.71 GRIA3 (1.00) GRIA3GRIA4HPGDSMN1; SMN2ALDH1A1
Farampator SCHEMBL677135 0.71 GRIA3 (1.00) GRIA3GRIA4HPGDSMN1; SMN2ALDH1A1

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
EP-0960105-A1 BENZOFURAZAN COMPOUNDS WHICH ENHANCE AMPA RECEPTOR ACTIVITY The Regents of the University of California (US) 1999-12-01 EP disclosed
WO-1998035950-A1 BENZOFURAZAN COMPOUNDS WHICH ENHANCE AMPA RECEPTOR ACTIVITY CORTEX PHARMACEUTICALS, INC. (US) 1998-08-20 WO disclosed