SCHEMBL8551056

SCHEMBL8551056

CC1OC1Oc1ccc(F)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.35
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
FFAR1 O14842 1/20 0.33
MAOB P27338 2/20 0.33
AOC3 Q16853 1/20 0.33
GRIN1 Q05586 2/20 0.32
GRIN2B Q13224 2/20 0.32
PTGS1 P23219 2/20 0.31
PTGS2 P35354 2/20 0.31
MAOA P21397 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL10945428 0.79 LMNA (0.39) CA12CA9
SCHEMBL7332087 0.78 NFE2L2 (0.36) SOS1MAOBMAOA
SCHEMBL10364397 0.76 SLC6A2 (0.45) SLC6A4FFAR1MAOB
SCHEMBL7154266 0.76 SLC6A2 (0.45) SLC6A4FFAR1MAOB
SCHEMBL10339033 0.75 SLC6A2 (0.36) SLC6A4CA12CA9MEN1GAA
SCHEMBL844654 0.73 CYP2A6 (0.50) CA9MEN1GAAMAPTKMT2A
SCHEMBL7918190 0.72 SLC6A4 (0.45) HTR2ASLC6A4MEN1KMT2A
SCHEMBL24974304 0.72 GRIN1 (0.47) SOS1SLC6A4MAOBAOC3GRIN1
SCHEMBL11303274 0.71 CA1 (0.50) CA12CA9MEN1GAAMAPT
SCHEMBL2020485 0.69 TDP1 (0.44) MAOBMAOAMEN1GAAMAPT

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-0842174-A1 HETEROCYCLIC COMPOUNDS FOR TREATING MYOCARDIAL ISCHAEMIA PIERRE FABRE MEDICAMENT (FR) 1998-05-20 EP disclosed
WO-1997005134-A1 HETEROCYCLIC COMPOUNDS FOR TREATING MYOCARDIAL ISCHAEMIA PIERRE FABRE MEDICAMENT (FR) 1997-02-13 WO disclosed