SCHEMBL14842008

SCHEMBL14842008

O=C1COC2(CCN(Cc3c(F)cc(-c4ccc5cccnc5c4)cc3F)CC2)CN1C1CC1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FASN P49327 9/20 0.65
CHRM1 P11229 3/20 0.40
CHRNA7 P36544 1/20 0.36
KDM1A O60341 1/20 0.35
GSK3B P49841 1/20 0.35
OPRM1 P35372 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
EGLN1 Q9GZT9 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL14842076 0.92 FASN (0.65) FASNCHRM1CHRNA7KDM1AGSK3B
SCHEMBL14842333 0.91 FASN (0.60) FASNCHRM1CHRNA7KDM1AGSK3B
SCHEMBL15543586 0.90 FASN (0.63) FASNCHRM1CHRNA7KDM1AGSK3B
SCHEMBL14842029 0.90 FASN (0.60) FASNCHRM1CHRNA7KDM1AGSK3B
SCHEMBL15582386 0.88 FASN (0.72) FASNCHRNA7GSK3BOPRM1SIGMAR1
SCHEMBL15543303 0.87 FASN (0.52) FASNCHRM1CHRNA7KDM1AGSK3B
SCHEMBL15544417 0.87 FASN (0.48) FASNOPRM1SIGMAR1
SCHEMBL15543895 0.87 FASN (0.49) FASNCHRM1OPRM1SIGMAR1
SCHEMBL14720426 0.87 FASN (0.64) FASNCHRNA7OPRM1SIGMAR1
SCHEMBL15543614 0.87 FASN (0.65) FASNCHRNA7KDM1AGSK3BOPRM1

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
WO-2014008223-A2 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-01-09 WO claimed
WO-2014008223-A2 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-01-09 WO disclosed
WO-2014008223-A2 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-01-09 WO disclosed
WO-2013052716-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-04-11 WO disclosed