SCHEMBL1275705

SCHEMBL1275705

Fc1[c]cc(C(F)(F)F)cc1-c1ccc(C(F)(F)F)cc1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
MPL P40238 2/20 0.42
CYP11B2 P19099 7/20 0.38
CYP11B1 P15538 6/20 0.38
APP P05067 1/20 0.38
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
HSD11B1 P28845 1/20 0.37
PDE2A O00408 3/20 0.37
GPR3 P46089 1/20 0.34
CDC14B O60729 1/20 0.34
CDC14A Q9UNH5 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
SCHEMBL27705144 0.85 ALOX5AP (0.31) IDO1MPLAPPALOX5APFEN1
SCHEMBL17134063 0.77 IDO1 (0.36) IDO1PDE2A
SCHEMBL1275706 0.73 MPL (0.40) IDO1MPLCYP11B2CYP11B1APP
SCHEMBL9736244 0.71 IDO1 (0.41) IDO1MPLCYP11B2CYP11B1APP
SCHEMBL6039958 0.68 MPL (0.47) IDO1MPLCYP11B2CYP11B1APP
SCHEMBL30568357 0.68 MPL (0.55) IDO1MPLPDE2AGPR3
SCHEMBL18361131 0.68 MPL (0.55) IDO1MPLPDE2AGPR3
SCHEMBL4395172 0.68 GPR3 (0.33) GPR3
SCHEMBL12887901 0.68 GPR3 (0.48) MPLGPR3
SCHEMBL20526087 0.67 CES2 (0.35)

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-2461685-A2 MIXTURES OF MESOIONIC PESTICIDES E. I. du Pont de Nemours and Company (US) 2012-06-13 EP disclosed
WO-2011017351-A2 MIXTURES OF MESOIONIC PESTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-02-10 WO disclosed