SCHEMBL4065138

SCHEMBL4065138

FC(F)(F)c1ccc(C2CC[CH]CC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.63
KIF11 P52732 1/20 0.39
KDM1A O60341 2/20 0.38
MAOB P27338 2/20 0.38

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
SCHEMBL9184420 0.89 HTR2C (0.56) HTR2C
SCHEMBL9184426 0.89 HTR2C (0.56) HTR2C
SCHEMBL1847401 0.87 HTR2C (0.73) HTR2CKDM1AMAOB
SCHEMBL15611355 0.83 HTR2C (0.44) HTR2CKDM1A
SCHEMBL5147805 0.83 HTR2C (0.68) HTR2CKDM1A
SCHEMBL2539686 0.83 HTR2C (0.68) HTR2CKDM1A
SCHEMBL14888841 0.81 HTR2C (0.51) HTR2C
Cyanide SCHEMBL27770959 0.81 HTR2C (0.66) HTR2CKDM1AMAOB
SCHEMBL3681390 0.81 HTR2C (0.66) HTR2CKDM1A
Dimethylamine SCHEMBL27903575 0.79 HTR2C (0.63) HTR2CKIF11KDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1415986-B1 SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS BANYU PHARMA CO LTD (JP) 2009-04-08 EP disclosed
US-7205417-B2 Spiro compounds BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-04-17 US disclosed
US-5380462-A Cyclohexyl alkenoate compounds HOFFMANN-LA ROCHE INC. (US) 1995-01-10 US disclosed