SCHEMBL2604840

SCHEMBL2604840

CCc1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
PDE10A Q9Y233 3/20 0.45
RECQL P46063 1/20 0.43
CYP1A2 P05177 1/20 0.42
POLB P06746 2/20 0.41
HSP90AA1 P07900 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GRIA1 P42261 1/20 0.40
CACNG8 Q8WXS5 1/20 0.40
CACNG2 Q9Y698 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL25769019 1.00 MEN1 (0.50) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL879276 1.00 MEN1 (0.50) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL26343653 1.00 MEN1 (0.50) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL29449951 1.00 MEN1 (0.50) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL29500228 0.99 MEN1 (0.51) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL17341687 0.99 MEN1 (0.51) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL26343681 0.95 ALDH1A1 (0.46) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL21392418 0.95 ALDH1A1 (0.46) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL24674447 0.94 MEN1 (0.45) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL24674385 0.94 MEN1 (0.45) MEN1KMT2AMAPTKDM4EALDH1A1

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-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed