SCHEMBL17849643

SCHEMBL17849643

CC1(C)c2cc(-c3ccccc3)cc3ccc4cc(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc1c4c23

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
BACE1 P56817 1/20 0.34
LPL P06858 2/20 0.34
LIPG Q9Y5X9 2/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CRHBP P24387 1/20 0.33
ATM Q13315 1/20 0.33
CRHR2 Q13324 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
SCHEMBL17849610 1.00 L3MBTL1 (0.34) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL15316871 0.96 LPL (0.32) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL17849616 0.93 LPL (0.33) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL17849620 0.93 LPL (0.43) ALDH1A1CYP1A2CYP2C9CYP2C19ESR1
SCHEMBL13888810 0.92 LPL (0.34) ESR1ESR2BACE1LPLLIPG
SCHEMBL17849683 0.92 LPL (0.34) ESR1ESR2BACE1LPLLIPG
SCHEMBL13888805 0.92 LPL (0.34) ESR1ESR2BACE1LPLLIPG
SCHEMBL13888806 0.92 LPL (0.34) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL13888803 0.92 LPL (0.34) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL17849617 0.92 LPL (0.34) ESR1ESR2BACE1LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed