SCHEMBL8962853

SCHEMBL8962853

Fc1cc(C2CCC([C@H]3CC[C@H](/C=C/Cl)CC3)CC2)ccc1OC(F)F

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.36
PDE10A Q9Y233 1/20 0.36
MGLL Q99685 2/20 0.32

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
SCHEMBL8963223 0.96 PDE2A (0.35) PDE2APDE10AMGLL
SCHEMBL8963217 0.96 PDE2A (0.35) PDE2APDE10AMGLL
SCHEMBL8963104 0.87 JAK2 (0.34) PDE2APDE10A
SCHEMBL8963112 0.87 JAK2 (0.34) PDE2APDE10A
SCHEMBL8963152 0.85 PDE2A (0.31) PDE2APDE10A
SCHEMBL8451380 0.85 PDE2A (0.31) PDE2APDE10AMGLL
SCHEMBL8451384 0.85 PDE2A (0.31) PDE2APDE10AMGLL
SCHEMBL8963038 0.84
SCHEMBL8767140 0.83 PDE4B (0.37) PDE2APDE10AMGLL
SCHEMBL8962943 0.83 EPHX2 (0.34) PDE2A

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-0559860-B1 HALOVINYL-DERIVATIVES HOFFMANN LA ROCHE (CH) 1996-02-14 EP disclosed
US-5364556-A Halovinyl-derivatives HOFFMANN-LA ROCHE INC. (US) 1994-11-15 US disclosed