SCHEMBL7847412

SCHEMBL7847412

CC(C)(C)OC(=O)N1CCN(c2ccc(N3C[C@H](CNC(O)=S)OC3=O)cc2F)CC1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.62
MAOA P21397 5/20 0.62
LMNA P02545 1/20 0.60
PTGS1 P23219 1/20 0.60
CALML3 P27482 1/20 0.60
SDHA P31040 1/20 0.60
F10 P00742 11/20 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
SCHEMBL7847416 1.00 MAOB (0.62) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14310688 0.94 MAOB (0.64) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3396464 0.93 MAOB (0.60) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3394709 0.93 MAOB (0.60) MAOBMAOALMNAPTGS1CALML3
SCHEMBL2088355 0.92 MAOB (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5412018 0.91 MAOB (0.73) MAOBMAOALMNAPTGS1CALML3
SCHEMBL8577685 0.91 MAOB (0.73) MAOBMAOALMNAPTGS1CALML3
SCHEMBL2089876 0.91 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL2090602 0.91 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7847408 0.91 MAOB (0.61) MAOBMAOALMNAPTGS1CALML3

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 1 patent. 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