SCHEMBL11089929

SCHEMBL11089929

O=C1Cc2cc(Oc3ccccc3)ccc2N1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 1/20 0.63
MAOB P27338 9/20 0.56
MAOA P21397 6/20 0.56
AHR P35869 2/20 0.53
PDK2 Q15119 1/20 0.53
KIF11 P52732 1/20 0.52
GRIA1 P42261 2/20 0.49
CACNG8 Q8WXS5 2/20 0.49
GAA P10253 1/20 0.47
PGR P06401 1/20 0.47
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
EPHX2 P34913 1/20 0.44

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
SCHEMBL13282888 0.87 EIF2AK2 (0.84) EIF2AK2MAOBMAOAAHRPDK2
SCHEMBL11089100 0.86 AHR (0.68) EIF2AK2MAOBMAOAAHRPDK2
SCHEMBL5638486 0.86 EIF2AK2 (0.61) EIF2AK2MAOBAHRPDK2KIF11
SCHEMBL11094738 0.81 MAOB (0.53) EIF2AK2MAOBMAOAAHRPDK2
SCHEMBL3285782 0.80 NPC1 (0.59) MAOBMAOAAHRPDK2GRIA1
SCHEMBL4751126 0.79 MAOB (0.78) MAOBMAOAPDE3BPDE3A
SCHEMBL3311667 0.79 KIF11 (0.59) MAOBMAOAKIF11PGRPDE3B
SCHEMBL22904229 0.78 MAOA (0.62) EIF2AK2MAOBMAOA
SCHEMBL31040124 0.78 PDE3B (0.66) EIF2AK2MAOBMAOAAHRPDK2
SCHEMBL20214 0.78 PDE3B (0.66) EIF2AK2MAOBMAOAAHRPDK2

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
US-8455529-B2 Kinase inhibitors ALLERGAN, INC. (US) 2013-06-04 US disclosed
WO-2010075197-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2010-07-01 WO disclosed
WO-2008022013-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2008-02-21 WO disclosed
US-4472433-A Phenoxyphenyl acetic acids and their medicinal use FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed
EP-0008226-B1 PHENYL-ALKANOIC ACID DERIVATIVES, THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-02 EP disclosed
EP-0008226-A2 Phenyl-alkanoic acid derivatives, the preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-02-20 EP disclosed