SCHEMBL5816746

SCHEMBL5816746

CC(=O)NC[C@H]1CN(c2ccc(N3CCN(c4ccc(-c5nnc(C)o5)c(F)c4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.67
MAOB P27338 5/20 0.67
PTGS1 P23219 2/20 0.67
SDHA P31040 2/20 0.67
LMNA P02545 1/20 0.67
CALML3 P27482 1/20 0.67
F10 P00742 7/20 0.55

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
SCHEMBL2899759 0.88 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7482960 0.88 MAOB (0.73) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7482947 0.88 MAOB (0.73) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2896814 0.84 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5409184 0.84 MAOB (0.67) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5409180 0.84 MAOB (0.67) MAOAMAOBPTGS1SDHALMNA
SCHEMBL16204406 0.83 MAOA (0.83) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6988071 0.83 MAOA (0.83) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6979510 0.83 MAOA (0.83) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8575132 0.83 MAOB (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006051408-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2006-05-18 WO disclosed