SCHEMBL15469063

SCHEMBL15469063

c1ccc2c(c1)c1ccccc1n2-c1ccnc(-c2cc(-n3c4ccccc4c4ccccc43)ccn2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
ATM Q13315 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
MCL1 Q07820 4/20 0.36
GPR3 P46089 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 1/20 0.34
POLB P06746 2/20 0.34
SLC6A2 P23975 1/20 0.34
COMT P21964 1/20 0.34
LMNA P02545 1/20 0.33
METAP1 P53582 1/20 0.33
BLM P54132 1/20 0.33
HIF1A Q16665 1/20 0.33
DOHH Q9BU89 1/20 0.33

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
SCHEMBL30376996 0.90 L3MBTL1 (0.50) KDM4EATML3MBTL1MCL1COMT
SCHEMBL19972423 0.90 L3MBTL1 (0.50) KDM4EATML3MBTL1MCL1COMT
SCHEMBL26841745 0.89 KDM4E (0.42) KDM4EATML3MBTL1CCR1CCR5
SCHEMBL19349630 0.87 KDM4E (0.47) KDM4EATML3MBTL1MCL1COMT
SCHEMBL3102322 0.84 TGFBR1 (0.43) KDM4EATML3MBTL1MCL1COMT
SCHEMBL29516887 0.83 KDM4E (0.47) KDM4EATML3MBTL1
SCHEMBL16252049 0.83 KDM4E (0.47) KDM4EATML3MBTL1
SCHEMBL15394891 0.83 KDM4E (0.50) KDM4EATML3MBTL1GPR3MKNK1
SCHEMBL23196707 0.83 L3MBTL1 (0.40) KDM4EATML3MBTL1COMTMETAP1
SCHEMBL3105279 0.82 KDM4E (0.39) KDM4EATML3MBTL1MCL1ALDH1A1

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-20150129861-A1 ORGANIC MATERIAL FOR DEPOSITION, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, DEPOSITION METHOD, AND MANUFACTURING METHOD FOR ORGANIC PHOTOELECTRONIC ONVERSION ELEMENT OBTAINED USING THE SAME FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-20150129861-A1 ORGANIC MATERIAL FOR DEPOSITION, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, DEPOSITION METHOD, AND MANUFACTURING METHOD FOR ORGANIC PHOTOELECTRONIC ONVERSION ELEMENT OBTAINED USING THE SAME FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-20140042411-A1 METHOD FOR PURIFYING ORGANIC MATERIAL, MATERIAL FOR ORGANIC ELECTRONICS, PHOTOELECTRIC CONVERSION DEVICE, OPTICAL SENSOR, IMAGING DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2014-02-13 US disclosed