SCHEMBL5808176

SCHEMBL5808176

O=C1O[C@@H](CO)CN1c1ccc(N2CCN(c3ccc([N+](=O)[O-])s3)CC2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.51
MAOA P21397 3/20 0.51
CALML3 P27482 5/20 0.50
F10 P00742 8/20 0.49
LMNA P02545 1/20 0.49
PTGS1 P23219 1/20 0.49
SDHA P31040 1/20 0.49

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
SCHEMBL5799591 0.92 MAOB (0.48) MAOBMAOACALML3F10LMNA
SCHEMBL6508885 0.92 MAOB (0.48) MAOBMAOACALML3F10LMNA
SCHEMBL5822534 0.89 MAOB (0.49) MAOBMAOACALML3F10LMNA
SCHEMBL5799311 0.89 MAOB (0.59) MAOBMAOACALML3F10LMNA
SCHEMBL6510766 0.88 MAOB (0.45) MAOBMAOACALML3F10LMNA
SCHEMBL5807573 0.88 MAOB (0.45) MAOBMAOACALML3F10LMNA
SCHEMBL5814097 0.88 MAOA (0.49) MAOBMAOACALML3F10LMNA
SCHEMBL5726745 0.88 MAOA (0.70) MAOBMAOACALML3F10LMNA
SCHEMBL6512465 0.88 MAOB (0.60) MAOBMAOACALML3F10LMNA
SCHEMBL5807776 0.88 MAOB (0.51) MAOBMAOACALML3F10LMNA

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
WO-2006043121-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2006-04-27 WO claimed
WO-2006043121-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2006-04-27 WO disclosed