SCHEMBL8501013

SCHEMBL8501013

CC(C(N)=O)C1CN(c2cccc(F)c2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 6/20 0.53
GRM2 Q14416 2/20 0.50
MAOA P21397 2/20 0.43
POLB P06746 3/20 0.43
MAOB P27338 1/20 0.42
LMNA P02545 4/20 0.41
PIK3CD O00329 1/20 0.40
CALML3 P27482 1/20 0.39

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
SCHEMBL6796825 0.86 GRM2 (0.54) FADS1GRM2MAOAPOLBMAOB
SCHEMBL27576681 0.85 GRM2 (0.53) FADS1GRM2MAOAPOLBMAOB
SCHEMBL6612471 0.85 FADS1 (0.57) FADS1GRM2MAOAPOLBMAOB
SCHEMBL8436019 0.85 GRM2 (0.46) FADS1GRM2MAOAMAOB
SCHEMBL5571718 0.84 MAOA (0.41) FADS1GRM2MAOAMAOBCALML3
SCHEMBL27573655 0.82 MAOA (0.45) MAOAMAOBLMNACALML3
SCHEMBL6233214 0.82 MAOA (0.45) MAOAMAOBLMNACALML3
SCHEMBL6233210 0.82 MAOA (0.45) MAOAMAOBLMNACALML3
SCHEMBL28110356 0.82 MAOA (0.47) GRM2MAOAMAOBLMNACALML3
SCHEMBL27481286 0.82 MAOA (0.47) GRM2MAOAMAOBLMNACALML3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103044347-A Synthetic method of antibacterial drug LUO XINJIE 2013-04-17 CN disclosed
US-5929248-A Substituted heteroarylphenyloxazolidinones PHARMACIA & UPJOHN COMPANY (US) 1999-07-27 US disclosed
US-5801246-A BACTERICIDES PHARMACIA & UPJOHN COMPANY (US) 1998-09-01 US disclosed
US-5756732-A Substituted heteroarylphenyloxazolidinones PHARMACIA & UPJOHN COMPANY (US) 1998-05-26 US disclosed