SCHEMBL6608314

SCHEMBL6608314

N#Cc1ccc(N2CCN(c3ccc(N4C[C@H](COc5ccncn5)OC4=O)cc3F)CC2)nc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.44
MAOB P27338 9/20 0.43
MAOA P21397 5/20 0.43
CALML3 P27482 2/20 0.43
LMNA P02545 1/20 0.41
PTGS1 P23219 1/20 0.41
SDHA P31040 1/20 0.41
F10 P00742 3/20 0.40
GRM2 Q14416 1/20 0.40
GRM5 P41594 2/20 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
SCHEMBL6607807 0.91 KCNH2 (0.44) KCNH2MAOBMAOACALML3LMNA
SCHEMBL6609310 0.91 KCNH2 (0.44) KCNH2MAOBMAOACALML3LMNA
SCHEMBL6607367 0.88 KCNH2 (0.45) KCNH2MAOBMAOACALML3LMNA
SCHEMBL7084722 0.88 KCNH2 (0.42) KCNH2MAOBMAOACALML3LMNA
SCHEMBL6606648 0.86 KCNH2 (0.43) KCNH2MAOBMAOACALML3LMNA
SCHEMBL6607491 0.86 CALML3 (0.51) KCNH2MAOBMAOACALML3LMNA
SCHEMBL7844768 0.84 TIPARP (0.36) KCNH2
SCHEMBL7849825 0.78 KCNH2 (0.47) KCNH2MAOBMAOACALML3LMNA
SCHEMBL7077082 0.76 KCNH2 (0.45) KCNH2MAOBMAOACALML3LMNA
SCHEMBL7077086 0.76 KCNH2 (0.45) KCNH2MAOBMAOACALML3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082322-B1 OXAZOLIDINONE DERIVATIVES AS ANTIBIOTIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2004-01-28 EP claimed
EP-1082322-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AstraZeneca AB (SE) 2001-03-14 EP claimed
WO-1999064416-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 1999-12-16 WO claimed
EP-1082322-B1 OXAZOLIDINONE DERIVATIVES AS ANTIBIOTIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2004-01-28 EP disclosed
EP-1357122-A2 Oxazolidinone compounds and pharmaceutical compositions containing them AstraZeneca AB (SE) 2003-10-29 EP disclosed