SCHEMBL14720248

SCHEMBL14720248

O=C1COC2(CCN(CC(O)c3ccc(-c4ccc5cccnc5c4)cc3F)CC2)CN1C1CC1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FASN P49327 7/20 0.61
KCNJ1 P48048 9/20 0.38
KCNH2 Q12809 1/20 0.37
KDM1A O60341 1/20 0.35
GSK3B P49841 1/20 0.35
CHRNA7 P36544 1/20 0.34

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
SCHEMBL14720237 0.86 FASN (0.61) FASNKDM1AGSK3BCHRNA7
SCHEMBL14729648 0.85 FASN (0.64) FASNKDM1AGSK3BCHRNA7
SCHEMBL14842076 0.85 FASN (0.65) FASNKDM1AGSK3BCHRNA7
SCHEMBL14842008 0.85 FASN (0.65) FASNKDM1AGSK3BCHRNA7
SCHEMBL14720427 0.85 FASN (0.61) FASNKDM1AGSK3BCHRNA7
SCHEMBL18106920 0.84 FASN (0.59) FASNKDM1AGSK3BCHRNA7
SCHEMBL14720097 0.84 FASN (0.60) FASNKDM1AGSK3BCHRNA7
SCHEMBL14720426 0.84 FASN (0.64) FASNKCNH2CHRNA7
SCHEMBL15543586 0.83 FASN (0.63) FASNKDM1AGSK3BCHRNA7
SCHEMBL14720232 0.83 FASN (0.59) FASNKDM1AGSK3BCHRNA7

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
EP-2744333-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2014-06-25 EP claimed
WO-2013028447-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-02-28 WO claimed
EP-2744333-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2014-06-25 EP disclosed
WO-2013028447-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-02-28 WO disclosed