SCHEMBL6619924

SCHEMBL6619924

O=C(NC[C@H]1CN(c2ccc(C3C=CSC(O)C3O)cc2)C(=O)O1)C(F)F

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.45
MAOA P21397 2/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL6619705 0.90 F10 (0.47) F10
SCHEMBL6621745 0.90 F10 (0.43) F10MAOAMAOB
SCHEMBL5214903 0.89 MAOA (0.47) F10MAOAMAOB
SCHEMBL6618538 0.87 MAOA (0.52) F10MAOAMAOB
SCHEMBL6616382 0.85 F10 (0.48) F10
SCHEMBL6040394 0.83 F10 (0.44) F10MAOAMAOB
SCHEMBL6617616 0.81 F10 (0.47) F10MAOAMAOB
Hydrochloric Acid SCHEMBL6621165 0.79 F10 (0.49) F10
SCHEMBL6621480 0.79 MAOA (0.44) F10MAOAMAOB
SCHEMBL5739169 0.78 F10 (0.51) F10MAOB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1467992-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2004-10-20 EP claimed
WO-2003062231-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2003-07-31 WO claimed
EP-1467992-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2004-10-20 EP disclosed
WO-2003062231-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2003-07-31 WO disclosed