SCHEMBL8129288

SCHEMBL8129288

CC(=O)NC[C@H]1CN(c2ccc3ncsc3c2)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.56
MAOB P27338 2/20 0.56
PTGS1 P23219 2/20 0.55
SDHA P31040 2/20 0.55
LMNA P02545 1/20 0.55
CALML3 P27482 1/20 0.55
ABCB11 O95342 1/20 0.49
F10 P00742 6/20 0.48

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
SCHEMBL7945886 0.89 MAOA (0.63) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8603523 0.86 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8124035 0.83 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8991492 0.81 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8115548 0.81 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8991351 0.81 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8991420 0.80 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8991376 0.80 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9029466 0.80 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9034428 0.79 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA

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-1049692-A1 NOVEL BICYCLENE-SUBSTITUTED OXAZOLIDINONES Bayer Aktiengesellschaft (DE) 2000-11-08 EP disclosed
WO-1999037641-A1 NOVEL BICYCLENE-SUBSTITUTED OXAZOLIDINONES BAYER AKTIENGESELLSCHAFT (DE) 1999-07-29 WO disclosed