SCHEMBL6570873

SCHEMBL6570873

c1ccc(N(c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.45
SIGMAR1 Q99720 6/20 0.36
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
PRSS1 P07477 1/20 0.34
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
PER2 O15055 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
CRY1 Q16526 1/20 0.32
CRY2 Q49AN0 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PTPN1 P18031 2/20 0.32
HDAC4 P56524 1/20 0.31
MAPK8 P45983 1/20 0.31

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
SCHEMBL31642 0.99 KDM4E (0.47) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL31644 0.95 KDM4E (0.49) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL23450684 0.94 L3MBTL1 (0.50) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL19342623 0.92 KDM4E (0.46) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL4400898 0.92 KDM4E (0.43) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL13932496 0.92 L3MBTL1 (0.48) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL12414435 0.92 L3MBTL1 (0.48) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL15138175 0.91 KDM4E (0.40) L3MBTL1KDM4EATMSIGMAR1F2
SCHEMBL3732155 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMSIGMAR1ALDH1A1
SCHEMBL10029910 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMSIGMAR1ALDH1A1

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
EP-0908787-B1 Indolocarbazole Photoconductors XEROX CORP (US) 2004-04-14 EP claimed
EP-0908787-A2 Indolocarbazole Photoconductors Xerox Corporation (US) 1999-04-14 EP claimed
EP-0908787-B1 Indolocarbazole Photoconductors XEROX CORP (US) 2004-04-14 EP disclosed
EP-0906948-B1 Electroluminescent devices XEROX CORP (US) 2003-02-12 EP disclosed
EP-0908787-A2 Indolocarbazole Photoconductors Xerox Corporation (US) 1999-04-14 EP disclosed