SCHEMBL29349686

SCHEMBL29349686

c1ccc2cc(Nc3cccc4c3oc3ccccc34)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.50
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
ALDH1A1 P00352 5/20 0.47
MAPT P10636 3/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
HPGD P15428 3/20 0.45
CYP3A4 P08684 2/20 0.45
HSD17B10 Q99714 2/20 0.45
FADS1 O60427 1/20 0.44
DUSP3 P51452 1/20 0.44
MAPK14 Q16539 1/20 0.42
RAB9A P51151 3/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
CDC25B P30305 1/20 0.40
ATM Q13315 1/20 0.40
RCE1 Q9Y256 1/20 0.39

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
SCHEMBL16282238 1.00 EPHX2 (0.50) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL29892343 0.89 DUSP3 (0.41) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL23690562 0.89 DUSP3 (0.41) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL24374078 0.87 MAPT (0.40) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL18471168 0.86 EPHX2 (0.45) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL26687305 0.86 FADS1 (0.41) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL21226190 0.85 DUSP3 (0.52) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL16185371 0.85 ALDH1A1 (0.45) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL24826942 0.85 MAPK14 (0.48) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL23561342 0.84 EPHX2 (0.51) EPHX2MEN1KMT2AALDH1A1MAPT

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
CN-113964275-A Light emitting device 三星显示有限公司 2022-01-21 CN disclosed