SCHEMBL19057601

SCHEMBL19057601

N=Cc1cc(Br)ccc1Nc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.38
AGPAT2 O15120 2/20 0.36
SLC10A2 Q12908 1/20 0.36
SLC10A1 Q14973 1/20 0.36
SLC10A6 Q3KNW5 1/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 1/20 0.35

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
SCHEMBL24153497 0.84 MEN1 (0.41) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL19624969 0.83 ALK (0.45) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL11400584 0.75 MAPK13 (0.49) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL24185261 0.73 MAPT (0.39) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL17177444 0.72 ALDH1A1 (0.35) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL18440560 0.71 LMNA (0.45) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL18485655 0.71 AGPAT2 (0.51) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL15638708 0.71 ALDH1A1 (0.45) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL20036833 0.71 MAPT (0.41) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL20180229 0.70 MEN1 (0.40) LMNAKMT2AMEN1ALDH1A1KDM4E

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-2017111439-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2017-06-29 WO disclosed