SCHEMBL4596405

SCHEMBL4596405

[CH2]C1Cc2cc(-c3ccccc3)cc(-c3cccc(F)c3)c2O1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
MAOB P27338 4/20 0.34
MAOA P21397 1/20 0.34
TAAR1 Q96RJ0 2/20 0.33
PARP10 Q53GL7 1/20 0.33
PARP11 Q9NR21 1/20 0.33
ESR2 Q92731 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 1/20 0.32
PRKAG2 Q9UGJ0 1/20 0.32
PRKAB1 Q9Y478 1/20 0.32
GRM2 Q14416 1/20 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
SCHEMBL4608664 0.88 GPR84 (0.35) HTR7MAOBMAOA
SCHEMBL4597645 0.88 AQP1 (0.40) HTR1AHTR7TAAR1PARP10PARP11
SCHEMBL4597503 0.85 MAOB (0.35) MAOBGRM2PDE4BAQP1
SCHEMBL4595401 0.84 NPC1 (0.36) HTR1AHTR7MAOBMAOAPARP10
SCHEMBL4596409 0.84 PARP1 (0.39) HTR1AHTR7MAOBMAOATAAR1
SCHEMBL5583519 0.84 CNR2 (0.36) MAOBPARP10PARP11HPGD
SCHEMBL4625848 0.83 PRKAB2 (0.45) HTR1AHTR7TAAR1PARP10PARP11
SCHEMBL4597049 0.83 HTR1A (0.38) HTR1AHTR7PRKAB2PRKAG1PRKAA2
SCHEMBL4596422 0.83 SLC6A9 (0.33) HTR1AHTR7PRKAB2PRKAG1PRKAA2
SCHEMBL4595105 0.82 TAAR1 (0.36) HTR1AHTR7TAAR1PARP10PARP11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007509174-A 2007-04-12 JP claimed
EP-1675840-A1 DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS Wyeth a Corporation of the State of Delaware (US) 2006-07-05 EP claimed
WO-2005044812-A1 DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS WYETH A CORPORATION OF THE STATE OF DELAWARE (US) 2005-05-19 WO claimed
EP-1874750-A1 DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS Wyeth Incoporated (US) 2008-01-09 EP disclosed
WO-2007030150-A1 DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS WYETH (US) 2007-03-15 WO disclosed
EP-1675840-A1 DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS Wyeth a Corporation of the State of Delaware (US) 2006-07-05 EP disclosed
WO-2005044812-A1 DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS WYETH A CORPORATION OF THE STATE OF DELAWARE (US) 2005-05-19 WO disclosed