SCHEMBL13633650

SCHEMBL13633650

Cc1ccc(/C=C/c2ccc3c(C(=O)Oc4c(C)cc(C(=O)OCc5ccccc5)cc4C)c4ccccc4nc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.38
KDM4E B2RXH2 5/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DHODH Q02127 3/20 0.37
TOP2A P11388 2/20 0.37
TOP2B Q02880 2/20 0.37
POLB P06746 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
APP P05067 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL13633574 0.95 DHODH (0.39) MAPTKDM4ELMNAALDH1A1HPGD
SCHEMBL4183514 0.92 NPC1 (0.44) KDM4EDHODHTOP2ATOP2BKMT2A
SCHEMBL4190377 0.92 MEN1 (0.42) TOP2ATOP2BAPPHDAC1HDAC2
SCHEMBL4339220 0.90 MAPT (0.39) MAPTKDM4ELMNAALDH1A1HPGD
SCHEMBL9631380 0.88 TDP1 (0.47) MAPTKDM4ELMNAALDH1A1HPGD
SCHEMBL4480370 0.87 MEN1 (0.42) APPHDAC1HDAC2HDAC8HDAC6
SCHEMBL13633577 0.87 DHODH (0.45) KDM4EDHODHTOP2ATOP2BKMT2A
SCHEMBL4192241 0.87 DHODH (0.45) KDM4EDHODHTOP2ATOP2BKMT2A
SCHEMBL7533840 0.85 TDP1 (0.42) MAPTKDM4ELMNAALDH1A1HPGD
SCHEMBL4183628 0.84 MAPT (0.39) MAPTKDM4ELMNAALDH1A1HPGD

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 1 patent. 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