SCHEMBL8991494

SCHEMBL8991494

CC(=O)NC[C@H]1CN(c2ccc3nc(C)oc3c2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
MAOB P27338 2/20 0.56
PTGS1 P23219 2/20 0.56
SDHA P31040 2/20 0.56
LMNA P02545 1/20 0.56
CALML3 P27482 1/20 0.56
ABCB11 O95342 1/20 0.47
F10 P00742 4/20 0.47

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
SCHEMBL8991420 0.83 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8991454 0.82 MAOA (0.48) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8866974 0.81 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL4101695 0.80 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9029466 0.80 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL4097835 0.80 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL15367964 0.80 MAOA (0.60) MAOAMAOBPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL8695876 0.80 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8124035 0.80 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL12950996 0.79 MAOA (0.72) 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
US-5529998-A ANTIBACTERIAL MEDICAMENTS BAYER AKTIENGESELLSCHAFT (DE) 1996-06-25 US disclosed
EP-0697412-A1 Benzoxazolyl- and benzo-thiazolyl-oxazolidinones BAYER AG (DE) 1996-02-21 EP disclosed