SCHEMBL8553737

SCHEMBL8553737

CC(=O)NC[C@H]1CN(c2ccc(C3=CCNC(C(=O)OC(C)(C)C)C3)c(F)c2)C(=O)O1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.59
MAOB P27338 4/20 0.54
PTGS1 P23219 2/20 0.54
SDHA P31040 2/20 0.54
LMNA P02545 1/20 0.54
CALML3 P27482 1/20 0.54
F10 P00742 3/20 0.44

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
SCHEMBL6400275 0.93 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8555853 0.93 MAOA (0.62) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8552787 0.88 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8551734 0.88 MAOA (0.62) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8553656 0.88 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8553013 0.87 MAOA (0.46) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8553735 0.82 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8023537 0.82 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL5678891 0.80 MAOA (0.71) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5678811 0.80 MAOA (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0856002-A1 PHENYLOXAZOLIDINONES HAVING A C-C BOND TO 4-8 MEMBERED HETEROCYCLIC RINGS PHARMACIA & UPJOHN COMPANY (US) 1998-08-05 EP disclosed
WO-1997009328-A1 PHENYLOXAZOLIDINONES HAVING A C-C BOND TO 4-8 MEMBERED HETEROCYCLIC RINGS PHARMACIA & UPJOHN COMPANY (US) 1997-03-13 WO disclosed