SCHEMBL31762

SCHEMBL31762

Fc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37
MAT2A P31153 1/20 0.36
MAPK8 P45983 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
USP14 P54578 1/20 0.35
REN P00797 1/20 0.34
CENPE Q02224 1/20 0.34
HSD17B10 Q99714 1/20 0.34
METAP2 P50579 1/20 0.34
HKDC1 Q2TB90 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
PER2 O15055 1/20 0.34
CRY1 Q16526 1/20 0.34
CRY2 Q49AN0 1/20 0.34

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
SCHEMBL14000413 0.93 KDM4E (0.51) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL20904403 0.92 KDM4E (0.47) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL20904251 0.92 KDM4E (0.47) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL12928070 0.91 KDM4E (0.53) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL20904496 0.91 ATM (0.53) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL8928087 0.91 KDM4E (0.53) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL8928188 0.91 KDM4E (0.53) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL8928252 0.91 KDM4E (0.53) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL31749 0.91 KDM4E (0.60) KDM4EATML3MBTL1MAPK8KMT2A
SCHEMBL31637 0.91 KDM4E (0.60) KDM4EATML3MBTL1MAPK8KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012026780-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-01 WO disclosed