SCHEMBL8945277

SCHEMBL8945277

NC(=O)Oc1cccc(C(N)COc2noc3ccccc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
FAAH O00519 2/20 0.39
MGLL Q99685 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
SCN4A P35499 4/20 0.37
HIF1A Q16665 1/20 0.35
SSTR4 P31391 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
PKM P14618 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ACHE P22303 1/20 0.33
KCNH2 Q12809 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
ACACB O00763 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32

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
SCHEMBL8945162 0.88 FAAH (0.41) FAAHMGLLSMN1; SMN2SCN4AHIF1A
SCHEMBL8945234 0.88 FAAH (0.45) KMT2AMEN1FAAHSMN1; SMN2SCN4A
Hydrochloric Acid SCHEMBL8945292 0.87 FAAH (0.44) KMT2AMEN1FAAHSMN1; SMN2SCN4A
SCHEMBL8944992 0.84 FAAH (0.44) FAAHMGLLSCN4AHIF1AL3MBTL1
SCHEMBL8945017 0.82 FAAH (0.43) KMT2AFAAHMGLLSMN1; SMN2SCN4A
SCHEMBL8945137 0.80 SCN4A (0.50) FAAHMGLLSCN4AACHEKCNH2
SCHEMBL8945444 0.76 FAAH (0.47) KMT2AMEN1FAAHSMN1; SMN2SCN4A
SCHEMBL8945130 0.76 FAAH (0.46) FAAHMGLLSCN4ASSTR4ACHE
Hydrochloric Acid SCHEMBL8945073 0.75 FAAH (0.47) KMT2AMEN1FAAHSMN1; SMN2SCN4A
SCHEMBL8944960 0.75 FAAH (0.45) KMT2AMEN1FAAHMGLLSMN1; SMN2

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-5578627-A FOR TREATING CEREBRAL CIRCULATORY DISORDER, HEAD INJURY SEQUELAE AND/OR EPILEPSY TOYAMA CHEMICAL CO., LTD. (JP) 1996-11-26 US disclosed
EP-0665226-A1 NOVEL 1,2-BENZISOXAZOLE DERIVATIVE OR SALT THEREOF, AND BRAIN PROTECTIVE AGENT COMPRISING THE SAME TOYAMA CHEMICAL CO., LTD. (JP) 1995-08-02 EP disclosed