SCHEMBL17849620

SCHEMBL17849620

CC1(C)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc3ccc4cc(-c5ccc6ccccc6c5)cc1c4c23

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.43
LIPG Q9Y5X9 1/20 0.43
ESR1 P03372 3/20 0.39
ESR2 Q92731 3/20 0.39
ALOX5 P09917 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
CYP1A2 P05177 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 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
SCHEMBL17849610 0.93 L3MBTL1 (0.34) LPLLIPGESR1ESR2CYP1A2
SCHEMBL17849643 0.93 L3MBTL1 (0.34) LPLLIPGESR1ESR2CYP1A2
SCHEMBL17849636 0.91 LPL (0.36) LPLLIPGESR1ESR2HSD17B1
SCHEMBL13888806 0.90 LPL (0.34) LPLLIPGCYP1A2ALDH1A1CYP2C9
SCHEMBL13888804 0.90 LPL (0.34) LPLLIPGCYP1A2ALDH1A1CYP2C9
SCHEMBL17849608 0.90 LPL (0.34) LPLLIPGCYP1A2ALDH1A1CYP2C9
SCHEMBL13888803 0.90 LPL (0.34) LPLLIPGCYP1A2ALDH1A1CYP2C9
SCHEMBL17849640 0.90 LPL (0.36) LPLLIPGESR1ESR2CHRNB2
SCHEMBL17849633 0.90 LPL (0.35) LPLLIPGCHRNB2CHRNB4CHRNA3
SCHEMBL17849616 0.89 LPL (0.33) LPLLIPGESR1ESR2CYP1A2

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