SCHEMBL8945033

SCHEMBL8945033

CS(=O)(=O)CC(N)COc1noc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.48
MGLL Q99685 1/20 0.48
CA2 P00918 5/20 0.43
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA9 Q16790 3/20 0.43
LMNA P02545 1/20 0.43
CA3 P07451 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
MAOB P27338 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA13 Q8N1Q1 1/20 0.43
CA14 Q9ULX7 1/20 0.43
CA5B Q9Y2D0 1/20 0.43
SSTR4 P31391 1/20 0.38
ACHE P22303 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL8945133 0.83 FAAH (0.46) FAAHMGLLCA2CA12CA1
SCHEMBL8945505 0.83 FAAH (0.46) FAAHMGLLCA2CA12CA1
SCHEMBL8945307 0.82 FAAH (0.57) FAAHMGLLCA2CA12CA1
Hydrochloric Acid SCHEMBL8945089 0.82 FAAH (0.46) FAAHMGLLCA2CA12CA1
SCHEMBL8945055 0.80 FAAH (0.51) FAAHMGLLCA2CA12CA1
Hydrochloric Acid SCHEMBL8945355 0.80 FAAH (0.55) FAAHMGLLCA2CA12CA1
SCHEMBL8944998 0.80 FAAH (0.58) FAAHMGLLCA2CA12CA1
SCHEMBL8945199 0.80 FAAH (0.51) FAAHMGLLCA2CA12CA1
SCHEMBL8945200 0.80 FAAH (0.50) FAAHMGLLCA2CA12CA1
SCHEMBL8945016 0.79 FAAH (0.56) FAAHMGLLCA2CA12CA1

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