SCHEMBL7846255

SCHEMBL7846255

O=C(S)NC[C@H]1CN(c2ccc(N3CCSCC3)c(F)c2)C(=O)O1

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.82
MAOA P21397 3/20 0.82
F10 P00742 13/20 0.74
LMNA P02545 1/20 0.66
PTGS1 P23219 1/20 0.66
CALML3 P27482 1/20 0.66
SDHA P31040 1/20 0.66

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
SCHEMBL5216684 0.91 MAOB (0.84) MAOBMAOAF10LMNAPTGS1
SCHEMBL6040545 0.90 MAOB (0.79) MAOBMAOAF10LMNAPTGS1
Sutezolid SCHEMBL2152519 0.90 MAOB (1.00) MAOBMAOAF10LMNAPTGS1
Sutezolid SCHEMBL29757643 0.90 MAOB (1.00) MAOBMAOAF10LMNAPTGS1
Sutezolid SCHEMBL2152517 0.90 MAOB (1.00) MAOBMAOAF10LMNAPTGS1
SCHEMBL18410470 0.89 MAOB (0.81) MAOBMAOAF10LMNAPTGS1
SCHEMBL18408828 0.89 MAOB (0.82) MAOBMAOAF10LMNAPTGS1
SCHEMBL7846260 0.88 MAOB (0.79) MAOBMAOAF10LMNAPTGS1
SCHEMBL6160301 0.88 MAOB (0.85) MAOBMAOAF10LMNAPTGS1
SCHEMBL3394603 0.88 F10 (0.72) MAOBMAOAF10LMNAPTGS1

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
EP-1130016-A1 THIOCARBAMIC ACID DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2001-09-05 EP disclosed
JP-2000204084-A THIOCARBAMIC ACID DERIVATIVE HOKURIKU SEIYAKU CO LTD 2000-07-25 JP disclosed