SCHEMBL13633649

SCHEMBL13633649

Cn1c2ccccc2c(=O)c2ccc(-c3ccc(O)cc3)cc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.61
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
ATM Q13315 1/20 0.59
GAA P10253 2/20 0.59
POLB P06746 2/20 0.59
RXFP1 Q9HBX9 2/20 0.59
RXRA P19793 1/20 0.57
RXRB P28702 1/20 0.57
PKM P14618 1/20 0.55
HTT P42858 2/20 0.51
MAPT P10636 1/20 0.51
HSD17B10 Q99714 3/20 0.50
CYP2C19 P33261 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
TLR9 Q9NR96 1/20 0.50

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
SCHEMBL27673123 0.91 RXRA (0.62) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL28278675 0.87 ATM (0.66) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL21166970 0.86 L3MBTL1 (0.63) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL19055418 0.84 L3MBTL1 (0.64) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL13633603 0.81 ATM (0.55) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL11378517 0.81 HTT (0.57) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL21167110 0.81 MAOB (0.57) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL18545828 0.81 L3MBTL1 (0.60) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL20987444 0.80 ATM (0.56) L3MBTL1NPC1RAB9AATMGAA
SCHEMBL16373476 0.80 GPR3 (0.70) L3MBTL1NPC1RAB9AATMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7611909-B1 Acridinium compound for use in the concurrent detection of target analytes in immunoassays or nucleic acid assays SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2009-11-03 US disclosed
US-7611909-B1 Acridinium compound for use in the concurrent detection of target analytes in immunoassays or nucleic acid assays SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2009-11-03 US disclosed
EP-1104405-B1 NEAR INFRARED CHEMILUMINESCENT ACRIDINIUM COMPOUNDS AND USES THEREOF SIEMENS HEALTHCARE DIAGNOSTICS (US) 2009-02-18 EP disclosed