SCHEMBL15042410

SCHEMBL15042410

c1ccc(N(c2ccccc2)c2cc(N(c3ccccc3)c3ccc4ccccc4c3)c3ccc4c(N(c5ccccc5)c5ccc6ccccc6c5)cc(N(c5ccccc5)c5ccc6ccccc6c5)c5ccc2c3c54)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
CYP3A4 P08684 3/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CYP1A2 P05177 6/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ERBB2 P04626 1/20 0.34
FYN P06241 1/20 0.34
MAOA P21397 1/20 0.34
ACHE P22303 1/20 0.34
AHR P35869 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
SLC6A2 P23975 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
SCHEMBL15042408 1.00 ALDH1A1 (0.35) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL13321029 1.00 ALDH1A1 (0.35) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL13321031 0.95 CYP1A2 (0.37) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL15042296 0.92 HSD17B1 (0.38) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL13320938 0.90 CYP1A2 (0.40) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL12887569 0.89 L3MBTL1 (0.35) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL25026516 0.89 CYP1A2 (0.39) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL2328563 0.89 CYP1A2 (0.39) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL10128558 0.89 CYP1A2 (0.42) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2
SCHEMBL17342439 0.89 ALDH1A1 (0.37) ALDH1A1CYP3A4HPGDHSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9431614-B2 Organic light emitting device LG DISPLAY CO., LTD. (KR) 2016-08-30 US disclosed
US-9431614-B2 Organic light emitting device LG DISPLAY CO., LTD. (KR) 2016-08-30 US disclosed
US-20130153867-A1 ORGANIC LIGHT EMITTING DEVICE LG DISPLAY CO., LTD. (KR) 2013-06-20 US disclosed
US-20130153867-A1 ORGANIC LIGHT EMITTING DEVICE LG DISPLAY CO., LTD. (KR) 2013-06-20 US disclosed