SCHEMBL7850683

SCHEMBL7850683

CC(=O)CCN1CCN(c2ccc(N3C[C@H](CNC(=O)S)OC3=O)cc2F)CC1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.65
MAOA P21397 4/20 0.65
PTGS1 P23219 2/20 0.65
SDHA P31040 2/20 0.65
LMNA P02545 1/20 0.65
CALML3 P27482 1/20 0.65
F10 P00742 10/20 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
SCHEMBL7850684 0.90 MAOB (0.64) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7850692 0.90 MAOB (0.64) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7846470 0.86 MAOB (0.67) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7846481 0.85 MAOB (0.61) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5571685 0.85 MAOB (0.76) MAOBMAOAPTGS1SDHALMNA
SCHEMBL27921352 0.85 MAOB (0.76) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7484589 0.84 MAOB (0.88) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7484599 0.84 MAOB (0.88) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7488307 0.84 MAOB (0.78) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7488304 0.84 MAOB (0.78) MAOBMAOAPTGS1SDHALMNA

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