SCHEMBL8935385

SCHEMBL8935385

CC[C@@H](NCc1ccc(OCc2ccccc2)cc1)C(N)=O

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.55
MAOA P21397 1/20 0.55
SCN9A Q15858 1/20 0.55

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
SCHEMBL7439130 1.00 MAOB (0.55) MAOBMAOASCN9A
SCHEMBL7398312 1.00 MAOB (0.55) MAOBMAOASCN9A
SCHEMBL27621008 0.90 BCHE (0.55) MAOBMAOASCN9A
SCHEMBL1070410 0.88 BCHE (0.54)
SCHEMBL7394895 0.88 BCHE (0.54)
SCHEMBL7396992 0.88 BCHE (0.54)
SCHEMBL19450068 0.86 POLB (0.51)
SCHEMBL3073641 0.86 MMP9 (0.60)
SCHEMBL5133922 0.86 MAOB (0.76) MAOBMAOASCN9A
SCHEMBL15195013 0.84 SCN9A (0.76) MAOBMAOASCN9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed
US-5391577-A Active on central nervous system; antiepileptic agents FARMITALIA CARLO ERBA S R L (IT) 1995-02-21 US disclosed
US-5236957-A Antiepileptic agents FARMITALIA CARLO ERBA SRL (IT) 1993-08-17 US disclosed