SCHEMBL7028448

SCHEMBL7028448

Oc1ccc(OCc2ccc(F)c(F)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.67
MAOA P21397 2/20 0.67
APP P05067 2/20 0.55
LMNA P02545 1/20 0.53
CYP1A2 P05177 1/20 0.53
PTGS1 P23219 1/20 0.53
SLC6A2 P23975 1/20 0.53
CYP2C19 P33261 1/20 0.53
PTGS2 P35354 1/20 0.53
SLC6A3 Q01959 1/20 0.53
HIF1A Q16665 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
PPARA Q07869 1/20 0.51
ACHE P22303 1/20 0.49
MME P08473 1/20 0.45
ACE P12821 1/20 0.45
CPA1 P15085 1/20 0.45
ACE2 Q9BYF1 1/20 0.45

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
SCHEMBL3929011 0.84 MAOB (0.50) MAOBMAOAAPPLMNACYP1A2
SCHEMBL30792426 0.84 MAOB (0.60) MAOBMAOAAPPPPARAACHE
SCHEMBL14541925 0.84 MAOB (0.65) MAOBMAOAAPPACHE
SCHEMBL5382147 0.84 MAOB (0.66) MAOBMAOAAPP
SCHEMBL18549924 0.83 MAOB (0.60) MAOBMAOAPPARAACHEMME
SCHEMBL7026399 0.80 MAOB (1.00) MAOBMAOAPPARA
SCHEMBL7026306 0.80 MAOB (0.74) MAOBMAOAPPARAACHEMME
SCHEMBL3228557 0.80 MAOB (0.56) MAOBMAOAAPPPPARAACHE
SCHEMBL14088929 0.80 MAOB (0.60) MAOBMAOAAPPLMNAPPARA
SCHEMBL15774625 0.80 RAB9A (0.63) MAOBMAOALMNAPPARAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007040682-A1 BIARYL SUBSTITUTED HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION DECODE GENETICS EHF. (IS) 2007-04-12 WO disclosed
CN-1127476-C 2-phenoxyaniline derivs. TAISHO PHARMACEUTICAL CO LTD (JP) 2003-11-12 CN disclosed
EP-1031556-B1 2-PHENOXYANILINE DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2003-01-22 EP disclosed
US-6162832-A 2-Phenoxyaniline derivatives TAISHO PHARMACEUTICAL CO., INC. (JP) 2000-12-19 US disclosed
CN-1276783-A 2-Phenoxyaniline Derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 2000-12-13 CN disclosed
EP-1031556-A1 2-PHENOXYANILINE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD (JP) 2000-08-30 EP disclosed