SCHEMBL6236409

SCHEMBL6236409

CC(C)(C)OC(=O)C1[C@H]2CN(c3ccc(N4C(=O)OCC4C[AsH]C(=O)C(Cl)Cl)cc3F)C[C@@H]12

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.34
MAOB P27338 6/20 0.33
MAOA P21397 3/20 0.33
LMNA P02545 1/20 0.33
PTGS1 P23219 1/20 0.33
CALML3 P27482 1/20 0.33
SDHA P31040 1/20 0.33
HDAC1 Q13547 4/20 0.32
HDAC8 Q9BY41 4/20 0.32
HDAC6 Q9UBN7 4/20 0.32
HDAC5 Q9UQL6 1/20 0.32
USP30 Q70CQ3 1/20 0.30

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
SCHEMBL6236407 0.84 MAOB (0.46) F10MAOBMAOALMNAPTGS1
SCHEMBL6208415 0.82 MAOB (0.40) F10MAOBMAOALMNAPTGS1
SCHEMBL6477905 0.73 MAOB (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL6477003 0.72 MAOB (0.52) F10MAOBMAOALMNAPTGS1
SCHEMBL6209789 0.72 F10 (0.32) F10MAOBMAOALMNAPTGS1
SCHEMBL6478291 0.71 MAOB (0.51) F10MAOBMAOALMNAPTGS1
SCHEMBL6478123 0.71 F10 (0.41) F10MAOBMAOALMNAPTGS1
SCHEMBL7081325 0.70 L3MBTL1 (0.44) MAOBMAOALMNAUSP30
SCHEMBL7081327 0.70 L3MBTL1 (0.44) MAOBMAOALMNAUSP30
SCHEMBL7163678 0.70 F10 (0.52) F10MAOBMAOALMNAPTGS1

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-1549641-A1 ANTIMICROBIAL 3.1.0 BICYCLIC OXAZOLIDINONE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2005-07-06 EP disclosed
WO-2004033451-A1 ANTIMICROBIAL [3.1.0] BICYCLIC OXAZOLIDINONE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-04-22 WO disclosed