SCHEMBL15423169

SCHEMBL15423169

CC1(C)c2cc(-c3ccc(-c4ccc5ccccc5c4)nc3)cc3ccc4cc(-c5cnccn5)cc1c4c23

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.42
CYP11B1 P15538 3/20 0.41
CYP11B2 P19099 3/20 0.41
CYP19A1 P11511 2/20 0.41
CYP17A1 P05093 1/20 0.41
ABL1 P00519 1/20 0.39
WNT3A P56704 3/20 0.36
PORCN Q9H237 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35
PIM1 P11309 2/20 0.35
PIM2 Q9P1W9 1/20 0.35
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CA P42336 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
SCHEMBL15423188 0.91 PIM1 (0.39) SIRT2CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL15423170 0.89 ALOX5AP (0.38) SIRT2ABL1WNT3ASLC6A2SLC6A4
SCHEMBL16168904 0.89 CYP11B1 (0.41) CYP11B1CYP11B2CYP19A1CYP17A1CYP2C9
SCHEMBL15423172 0.88 ABL1 (0.42) SIRT2CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL15423165 0.84 CYP2A6 (0.43) SIRT2CYP19A1ABL1SLC6A2SLC6A4
SCHEMBL15423161 0.80 TGFBR1 (0.41) ABL1WNT3AMAPK9MAPK10PIK3CD
SCHEMBL4144929 0.78 CYP11B1 (0.58) SIRT2CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL15603693 0.77 SIRT2 (0.43) SIRT2CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL15423174 0.76 BACE1 (0.36) SIRT2CYP19A1ABL1WNT3ASLC6A2
SCHEMBL15423186 0.76 ALDH1A1 (0.45) CYP2C9CYP2C19

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-9559310-B2 Compound with electron injection and/or electron transport capabilities and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-31 US disclosed
US-9559310-B2 Compound with electron injection and/or electron transport capabilities and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-31 US disclosed
US-20140014925-A1 NOVEL COMPOUND WITH ELECTRON INJECTION AND/OR ELECTRON TRANSPORT CAPABILITIES AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-01-16 US disclosed
US-20140014925-A1 NOVEL COMPOUND WITH ELECTRON INJECTION AND/OR ELECTRON TRANSPORT CAPABILITIES AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-01-16 US disclosed