SCHEMBL9029466

SCHEMBL9029466

CC(=O)NC[C@H]1CN(c2ccc3ncccc3c2)C(=O)O1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.55
MAOB P27338 2/20 0.55
PTGS1 P23219 2/20 0.55
SDHA P31040 2/20 0.55
LMNA P02545 1/20 0.55
CALML3 P27482 1/20 0.55
ABCB11 O95342 1/20 0.49
ACACB O00763 1/20 0.48
F10 P00742 3/20 0.46
AIMP2 Q13155 1/20 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
Hydrochloric Acid SCHEMBL8695876 0.99 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7947665 0.89 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7947671 0.86 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9211888 0.85 MAOA (0.60) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8701781 0.84 MAOA (0.56) MAOAMAOBCALML3ACACB
SCHEMBL1393281 0.83 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8341194 0.81 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL14069859 0.81 MAOA (0.48) MAOAMAOBPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL8787732 0.81 F10 (0.47) MAOAMAOBCALML3ACACBF10
SCHEMBL8991420 0.80 MAOA (0.56) 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
EP-0694543-A1 6-membered N-heteroaryloxazolidinones BAYER AG (DE) 1996-01-31 EP disclosed