SCHEMBL8945175

SCHEMBL8945175

C=Cc1ccc2onc(OCC(N)COC(N)=O)c2c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 1/20 0.33
FAAH O00519 1/20 0.32
CYP1A2 P05177 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL8944906 0.83 CYP1A2 (0.35) FAAHCYP1A2KDM4ELMNASMN1; SMN2
Hydrochloric Acid SCHEMBL8945306 0.83 FAAH (0.34) FAAHCYP1A2KDM4ELMNASMN1; SMN2
SCHEMBL8945107 0.83 FAAH (0.49) FAAHCYP1A2KDM4ESMN1; SMN2
SCHEMBL8945254 0.83 FAAH (0.34) FAAHCYP1A2KDM4ELMNASMN1; SMN2
Hydrochloric Acid SCHEMBL8945060 0.82 FAAH (0.48) FAAHCYP1A2KDM4ESMN1; SMN2
SCHEMBL8945191 0.80 KCNH2 (0.40) TBK1CYP1A2KDM4ELMNASMN1; SMN2
SCHEMBL8944960 0.80 FAAH (0.45) FAAHCYP1A2KDM4ELMNASMN1; SMN2
Hydrochloric Acid SCHEMBL8945170 0.80 FAAH (0.38) TBK1FAAHCYP1A2KDM4ELMNA
Hydrochloric Acid SCHEMBL8945351 0.80 FAAH (0.34) FAAHCYP1A2KDM4ELMNASMN1; SMN2
Hydrochloric Acid SCHEMBL8945510 0.79 FAAH (0.44) FAAHCYP1A2KDM4ELMNASMN1; 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