SCHEMBL8945252

SCHEMBL8945252

NC(COc1noc2ccc(Cl)cc12)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 10/20 0.51
KCNH2 Q12809 3/20 0.46
SCN5A Q14524 3/20 0.46
FAAH O00519 2/20 0.43
TACR1 P25103 1/20 0.43
ACHE P22303 1/20 0.37
MGLL Q99685 1/20 0.36
KAT6A Q92794 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
SCHEMBL8944917 0.88 FAAH (0.44) SCN4AKCNH2SCN5AFAAHTACR1
SCHEMBL8945002 0.87 FAAH (0.42) SCN4AKCNH2SCN5AFAAHTACR1
SCHEMBL8945192 0.87 FAAH (0.40) SCN4AKCNH2SCN5AFAAH
SCHEMBL8945013 0.87 FAAH (0.44) SCN4AKCNH2SCN5AFAAH
Hydrochloric Acid SCHEMBL8945185 0.87 FAAH (0.44) SCN4AKCNH2SCN5AFAAHTACR1
SCHEMBL8944957 0.86 FAAH (0.41) SCN4AKCNH2SCN5AFAAH
Hydrochloric Acid SCHEMBL8945257 0.86 FAAH (0.41) SCN4AKCNH2SCN5AFAAHTACR1
SCHEMBL8945141 0.85 FAAH (0.47) SCN4AKCNH2SCN5AFAAHKAT6A
SCHEMBL8945137 0.84 SCN4A (0.50) SCN4AKCNH2SCN5AFAAHTACR1
SCHEMBL8945316 0.83 SCN4A (0.53) SCN4AKCNH2SCN5AFAAHTACR1

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