SCHEMBL8021979

SCHEMBL8021979

CC(=O)NC[C@H]1CN(c2ccc(C3=CNC(C(=O)CO)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.62
CALML3 P27482 4/20 0.54
MAOB P27338 3/20 0.54
PTGS1 P23219 2/20 0.54
SDHA P31040 2/20 0.54
LMNA P02545 1/20 0.54
F10 P00742 2/20 0.43

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
SCHEMBL8554073 0.91 MAOA (0.58) MAOACALML3MAOBPTGS1SDHA
SCHEMBL8023537 0.89 MAOA (0.64) MAOACALML3MAOBPTGS1SDHA
SCHEMBL8551734 0.84 MAOA (0.62) MAOACALML3MAOBPTGS1SDHA
SCHEMBL3328441 0.82 MAOA (0.76) MAOACALML3MAOBPTGS1SDHA
SCHEMBL3328443 0.82 MAOA (0.76) MAOACALML3MAOBPTGS1SDHA
SCHEMBL5678812 0.79 MAOA (0.71) MAOACALML3MAOBPTGS1SDHA
Hydrochloric Acid SCHEMBL5678897 0.79 MAOA (0.71) MAOACALML3MAOBPTGS1SDHA
SCHEMBL5678811 0.79 MAOA (0.71) MAOACALML3MAOBPTGS1SDHA
Hydrochloric Acid SCHEMBL5678891 0.79 MAOA (0.71) MAOACALML3MAOBPTGS1SDHA
SCHEMBL1393698 0.79 MAOA (0.69) MAOACALML3MAOBPTGS1SDHA

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
US-6166056-A Phenyloxazolidinones having a C-C bond to 4-8 membered heterocyclic rings PHARMACIA (US) 2000-12-26 US disclosed