SCHEMBL19987989

SCHEMBL19987989

Nc1ccc2c(c1)c1cc3ccccc3cc1n2-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
KDM4E B2RXH2 4/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
ATM Q13315 1/20 0.46
HSD17B10 Q99714 3/20 0.42
CYP3A4 P08684 2/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
HBB P68871 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
HTT P42858 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HIF1A Q16665 1/20 0.41
NPC1 O15118 2/20 0.41
FGFR1 P11362 1/20 0.41

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
SCHEMBL257055 0.90 KDM4E (0.46) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL31633295 0.90 KDM4E (0.46) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL349768 0.89 KDM4E (0.56) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL29660559 0.89 KDM4E (0.56) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL23079608 0.86 L3MBTL1 (0.54) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL24254895 0.85 KDM4E (0.47) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL257001 0.84 KDM4E (0.67) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL29873418 0.84 KDM4E (0.67) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL16807745 0.84 L3MBTL1 (0.52) ALDH1A1KDM4EL3MBTL1ATMHSD17B10
SCHEMBL12774500 0.82 L3MBTL1 (0.69) ALDH1A1KDM4EL3MBTL1ATMMEN1

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
EP-3296288-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2018-03-21 EP disclosed