SCHEMBL6527480

SCHEMBL6527480

CN1C(=S)COc2cc(N3C(=O)OCC3CN)ccc21

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.34
F10 P00742 1/20 0.33
CYP11B1 P15538 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
PIK3CA P42336 1/20 0.30

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
SCHEMBL6527478 0.77 F10 (0.50) F10
SCHEMBL17287889 0.74 HSP90AA1 (0.42)
SCHEMBL5383830 0.72 MAOB (0.34)
SCHEMBL29950062 0.68 NOTUM (0.41) PIK3CA
SCHEMBL2107339 0.68 IDH1 (0.38) PIK3CA
SCHEMBL6675442 0.67 MAOB (0.47) F10PDE3BPDE3A
SCHEMBL6098143 0.67 CMA1 (0.36) F10
SCHEMBL6514888 0.66 F10 (0.61) F10
SCHEMBL6514891 0.66 F10 (0.61) F10
SCHEMBL7064886 0.66 LMNA (0.42)

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-2005082897-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed