SCHEMBL16999544

SCHEMBL16999544

c1ccc(-n2c3ccccc3c3c4ccccc4c4c(c5cc6c7c(cccc7c5n4-c4ccccc4)-c4ccccc4-6)c32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.39
KDM4E B2RXH2 3/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 6/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
CASP1 P29466 1/20 0.39
HIF1A Q16665 1/20 0.39
KDR P35968 1/20 0.34
HKDC1 Q2TB90 1/20 0.33
KMT2A Q03164 5/20 0.32
USP2 O75604 3/20 0.32
HTT P42858 2/20 0.32
KEAP1 Q14145 2/20 0.32
NFE2L2 Q16236 2/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL16999525 0.93 KDM4E (0.42) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL16999512 0.89 ALDH1A1 (0.45) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL16999535 0.86 KDM4E (0.44) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL16999526 0.85 KDM4E (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL16999374 0.85 KDM4E (0.52) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL21675968 0.85 ALDH1A1 (0.42) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL21676163 0.85 ALDH1A1 (0.42) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL21676159 0.84 L3MBTL1 (0.41) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL16999435 0.83 KDM4E (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL16999434 0.82 L3MBTL1 (0.44) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9419226-B2 Condensed fluoranthene compound, material for organic electroluminescent element using this compound, organic electroluminescent element using this material, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2016-08-16 US disclosed
US-9419226-B2 Condensed fluoranthene compound, material for organic electroluminescent element using this compound, organic electroluminescent element using this material, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2016-08-16 US disclosed
US-20150228904-A1 CONDENSED FLUORANTHENE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT USING THIS COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT USING THIS MATERIAL, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed
US-20150228904-A1 CONDENSED FLUORANTHENE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT USING THIS COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT USING THIS MATERIAL, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed