SCHEMBL15855403

SCHEMBL15855403

c1ccc(-n2c3ccc(-c4cccc(-c5cccc(-c6cccc(-c7cccc(-c8cccc(-n9c%10ccccc%10c%10ncccc%109)c8)c7)c6)c5)c4)cc3c3ncccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ATM Q13315 1/20 0.42
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 3/20 0.35
IL1R1 P14778 1/20 0.35
MEN1 O00255 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
GRM5 P41594 1/20 0.34
REN P00797 2/20 0.34
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 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
SCHEMBL15855399 1.00 L3MBTL1 (0.42) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL15855396 0.97 L3MBTL1 (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL15317294 0.95 L3MBTL1 (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL24601616 0.95 L3MBTL1 (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL29512160 0.95 L3MBTL1 (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL15855394 0.95 L3MBTL1 (0.43) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL26329972 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL17349310 0.94 L3MBTL1 (0.45) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL10041347 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL15855395 0.94 L3MBTL1 (0.47) L3MBTL1KDM4EATMALDH1A1TSHR

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-9537111-B2 Compound, material for organic electroluminescence device, and organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2017-01-03 US disclosed
US-20140183486-A1 NOVEL COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD (JP) 2014-07-03 US disclosed
US-20140183486-A1 NOVEL COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD (JP) 2014-07-03 US disclosed