SCHEMBL13079822

SCHEMBL13079822

C=C=COOCCCCOc1ccc(OCOc2ccc3cc(C)ccc3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.40
DRD2 P14416 4/20 0.36
DRD4 P21917 4/20 0.36
DRD3 P35462 3/20 0.36
APP P05067 10/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2A6 P11509 1/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 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
SCHEMBL13079820 0.99 KCNH2 (0.39) KCNH2DRD2DRD4DRD3APP
SCHEMBL13079821 0.91 DRD2 (0.41) KCNH2DRD2DRD4DRD3APP
SCHEMBL13079818 0.89 DRD2 (0.41) KCNH2DRD2DRD4DRD3APP
SCHEMBL13655354 0.89 DRD2 (0.41) KCNH2DRD2DRD4DRD3APP
SCHEMBL13079819 0.88 DRD2 (0.41) KCNH2DRD2DRD4DRD3HPGD
SCHEMBL13079823 0.86 L3MBTL1 (0.36) KCNH2DRD2DRD4DRD3NPC1
SCHEMBL13655359 0.84 PPARD (0.36) KCNH2DRD2DRD4DRD3NPC1
SCHEMBL13655365 0.80 NPC1 (0.40) NPC1RAB9ACYP1A2
SCHEMBL13655357 0.79 NPC1 (0.41) NPC1RAB9ACYP1A2
SCHEMBL13533999 0.76 NPC1 (0.37) NPC1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8284468-B2 Authenticating medium and authenticatable substrate DAI NIPPON PRINTING CO., LTD. (JP) 2012-10-09 US disclosed
US-7818782-B2 Authentication medium, authenticable substrate, authentication medium label, authentication medium transfer sheet, authenticable sheet, and authenticable information recording medium DAI NIPPON PRINTING CO., LTD. (JP) 2010-10-19 US disclosed
US-20090284813-A1 AUTHENTICATING MEDIUM AND AUTHENTICATABLE SUBSTRATE DAI NIPPON PRINTING CO., LTD. (JP) 2009-11-19 US disclosed
US-20080282322-A1 Authentication Medium, Authenticable Substate, Authentication Medium Label, Authentication Medium Transfer Sheet, Authenticable Sheet, and Authenticable Information Recording Medium DAI NIPPON PRINTING CO., LTD. (JP) 2008-11-13 US disclosed