SCHEMBL6509811

SCHEMBL6509811

CC(=O)NCC1CN(c2ccc(N3CCNC(C)C3)c(F)c2)C(=O)O1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.73
MAOB P27338 5/20 0.73
PTGS1 P23219 2/20 0.73
SDHA P31040 2/20 0.73
LMNA P02545 1/20 0.73
CALML3 P27482 1/20 0.73
F10 P00742 8/20 0.59

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
Trifluoroacetic Acid SCHEMBL6528038 0.95 MAOA (0.67) MAOAMAOBPTGS1SDHALMNA
SCHEMBL1498511 0.90 MAOA (0.80) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151522 0.90 MAOA (0.80) MAOAMAOBPTGS1SDHALMNA
SCHEMBL1894257 0.90 MAOA (0.80) MAOAMAOBPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL4689047 0.89 MAOA (0.79) MAOAMAOBPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL4689051 0.89 MAOA (0.79) MAOAMAOBPTGS1SDHALMNA
SCHEMBL11982941 0.87 MAOA (0.73) MAOAMAOBPTGS1SDHALMNA
SCHEMBL12547522 0.87 MAOA (0.76) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13367813 0.86 MAOA (0.72) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5818098 0.86 MAOA (0.75) 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-2005082899-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2005-09-09 WO disclosed