SCHEMBL9912922

SCHEMBL9912922

c1ccc(N(c2ccccc2)c2cccc(-n3c4ccc(N(c5ccccc5)c5ccccc5)cc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
L3MBTL1 Q9Y468 5/20 0.42
ATM Q13315 2/20 0.42
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
HPGD P15428 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 2/20 0.33
LMNA P02545 2/20 0.33
CRHBP P24387 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
SCHEMBL14661380 0.94 KDM4E (0.55) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL12559445 0.93 KDM4E (0.47) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL12856945 0.93 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL19429316 0.93 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL13301590 0.93 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL1144158 0.93 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL1981658 0.93 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL29450664 0.93 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL9912915 0.92 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL13301593 0.92 KDM4E (0.46) KDM4EL3MBTL1ATMALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed