SCHEMBL16456232

SCHEMBL16456232

N#Cc1ccc2c(c1)c1cc(-c3c4ccccc4c(-c4ccccn4)c4ccccc34)ccc1n2-c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 12/20 0.39
▸ METAP2 P50579 1/20 0.38
▸ METAP1 P53582 1/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HTR2C P28335 1/20 0.36
▸ MAPK13 O15264 1/20 0.35
▸ TGFBR1 P36897 1/20 0.35
▸ MAPK12 P53778 1/20 0.35
▸ MAPK11 Q15759 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35

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
SCHEMBL16456230 0.84 GRM5 (0.45) GRM5METAP2METAP1ABCG2KDM4E
SCHEMBL16456214 0.83 GRM5 (0.39) GRM5METAP2METAP1ABCG2KDM4E
SCHEMBL16549098 0.82 FABP1 (0.41) KDM4EMAPT
SCHEMBL16455794 0.82 CYP11B2 (0.46) ABCG2
SCHEMBL16548673 0.81 HTR1A (0.40) KDM4EALDH1A1MAPTHTR2CCA1
SCHEMBL16455797 0.81 FABP1 (0.38) —
SCHEMBL24478864 0.80 CA1 (0.41) TSHRCA1CA2
SCHEMBL16455790 0.80 CYP11B2 (0.45) ABCG2ALDH1A1TSHR
SCHEMBL16809572 0.80 CYP1A2 (0.45) ABCG2KDM4EALDH1A1MAPTTSHR
SCHEMBL16549079 0.80 GRM5 (0.39) GRM5HTR2CCA1CA2

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-9583715-B2 Anthracene-based compounds and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 — — US disclosed
US-20150041773-A1 ANTHRACENE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-02-12 — — US disclosed
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