SCHEMBL6620702

SCHEMBL6620702

CC(=O)NC[C@H]1CN(c2cc(F)c(C3CCSC(O)C3)c(F)c2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
MAOB P27338 3/20 0.57
PTGS1 P23219 2/20 0.53
SDHA P31040 2/20 0.53
LMNA P02545 1/20 0.53
CALML3 P27482 1/20 0.53
F10 P00742 5/20 0.43

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
SCHEMBL6160326 0.88 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7195331 0.88 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6162524 0.88 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6160328 0.88 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6161177 0.88 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6382854 0.88 MAOA (0.69) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6382863 0.88 MAOA (0.69) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6426220 0.86 MAOA (0.60) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5599063 0.85 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5221394 0.84 F10 (0.52) 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-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