SCHEMBL17849683

SCHEMBL17849683

CC1(C)c2cccc3ccc4cc(-c5ccc(-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc(-c8ccccc8)cc7)cc6)cc5)cc1c4c23

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
BACE1 P56817 1/20 0.31
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30

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
SCHEMBL13888810 1.00 LPL (0.34) LPLLIPGBACE1ESR1ESR2
SCHEMBL13888805 1.00 LPL (0.34) LPLLIPGBACE1ESR1ESR2
SCHEMBL17849617 1.00 LPL (0.34) LPLLIPGBACE1ESR1ESR2
SCHEMBL17849616 0.99 LPL (0.33) LPLLIPGBACE1ESR1ESR2
SCHEMBL13888804 0.97 LPL (0.34) LPLLIPG
SCHEMBL13888806 0.97 LPL (0.34) LPLLIPG
SCHEMBL17849608 0.97 LPL (0.34) LPLLIPG
SCHEMBL13888803 0.97 LPL (0.34) LPLLIPG
SCHEMBL13888800 0.95 LPL (0.34) LPLLIPGBACE1ESR1ESR2
SCHEMBL17849640 0.94 LPL (0.36) LPLLIPGBACE1ESR1ESR2

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