SCHEMBL7637521

SCHEMBL7637521

CC(=O)NCC1CN(c2ccc3c(c2)CC(C)N3)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
MAOB P27338 3/20 0.57
PTGS1 P23219 2/20 0.57
SDHA P31040 2/20 0.57
LMNA P02545 1/20 0.57
CALML3 P27482 1/20 0.57
F10 P00742 4/20 0.46
ABCB11 O95342 1/20 0.45

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
SCHEMBL6972089 1.00 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
Bromide SCHEMBL6960900 0.90 MAOA (0.48) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6961175 0.90 MAOA (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6969132 0.84 MAOA (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9175963 0.82 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6974798 0.81 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6974794 0.81 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9447658 0.80 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10433834 0.80 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10434027 0.80 MAOA (0.58) 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-1181288-A1 BICYCLIC OXAZOLIDINONES AS ANTIBACTERIAL AGENT PHARMACIA & UPJOHN COMPANY (US) 2002-02-27 EP disclosed
WO-2000073301-A1 BICYCLIC OXAZOLIDINONES AS ANTIBACTERIAL AGENT PHARMACIA & UPJOHN COMPANY (US) 2000-12-07 WO disclosed