SCHEMBL5583519

SCHEMBL5583519

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.36
CNR1 P21554 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAOB P27338 2/20 0.35
FYN P06241 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
ENPP3 O14638 1/20 0.34
ADORA1 P30542 2/20 0.34
DRD1 P21728 1/20 0.34
HTR2A P28223 1/20 0.34
PARP10 Q53GL7 1/20 0.33
PARP11 Q9NR21 1/20 0.33
HPRT1 P00492 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX1 P07099 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
SCHEMBL5583536 0.88 HPRT1 (0.46) NPC1RAB9AHPGDSMN1; SMN2MAOB
SCHEMBL4964942 0.88 FYN (0.34) CNR2CNR1NPC1RAB9AHPGD
SCHEMBL5583521 0.85 NPC1 (0.37) CNR2CNR1NPC1RAB9AHPGD
SCHEMBL4596405 0.84 HTR1A (0.36) HPGDMAOBPARP10PARP11
SCHEMBL4595401 0.84 NPC1 (0.36) NPC1RAB9ATSHRSMN1; SMN2MAOB
SCHEMBL5060185 0.84 AQP1 (0.40) NPC1RAB9ASMN1; SMN2MAOBFYN
SCHEMBL6047912 0.84 GPR84 (0.41) NPC1RAB9ASMN1; SMN2ADORA1ADORA2A
SCHEMBL6047945 0.83 GRIA1 (0.35) NPC1RAB9AHPGDTSHRSMN1; SMN2
SCHEMBL4712619 0.82 HTR1A (0.36) CNR2CNR1MAOB
SCHEMBL4230057 0.81 PRKAB2 (0.47) NPC1RAB9AHPGDTSHRSMN1; SMN2

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 5 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-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