SCHEMBL17801942

SCHEMBL17801942

CC1(C)OB(c2ccc(N3C[C@H](COC(=O)OC[C@H]4CN(c5ccc(B6OC(C)(C)C(C)(C)O6)c(F)c5)C(=O)O4)OC3=O)cc2F)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.45
CALML3 P27482 5/20 0.44
MAOB P27338 4/20 0.44
LMNA P02545 1/20 0.44
PTGS1 P23219 1/20 0.44
SDHA P31040 1/20 0.44
F10 P00742 2/20 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
SCHEMBL17801943 0.93 MAOA (0.45) MAOACALML3MAOBLMNAPTGS1
SCHEMBL24142630 0.89 CALML3 (0.42) MAOACALML3MAOBLMNAPTGS1
SCHEMBL411137 0.87 CALML3 (0.56) MAOACALML3MAOBLMNAPTGS1
SCHEMBL14838111 0.87 CALML3 (0.56) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13484703 0.86 F10 (0.46) MAOACALML3MAOBLMNAPTGS1
SCHEMBL10196142 0.86 CALML3 (0.44) MAOACALML3MAOBLMNAPTGS1
SCHEMBL1031591 0.85 MAOA (0.62) MAOACALML3MAOBLMNAPTGS1
SCHEMBL1031592 0.85 MAOA (0.62) MAOACALML3MAOBLMNAPTGS1
SCHEMBL5917572 0.84 MAOA (0.51) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3198635 0.84 CALML3 (0.41) MAOACALML3MAOBLMNAPTGS1

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-2016088101-A1 PROCESSES FOR THE PREPARATION OF TEDIZOLID PHOSPHATE AND ITS INTERMEDIATES SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2016-06-09 WO disclosed
WO-2016088100-A1 PROCESSES FOR THE PREPARATION OF TEDIZOLID PHOSPHATE AND ITS INTERMEDIATES SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2016-06-09 WO disclosed