SCHEMBL16455804

SCHEMBL16455804

N#Cc1ccc2c(c1)c1cc(-c3ccc4c(-c5ccc6ccccc6c5)c5cc(-c6ccccn6)ccc5c(-c5ccc6ccccc6c5)c4c3)ccc1n2-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 9/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ CYP17A1 P05093 1/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ METAP2 P50579 1/20 0.35
▸ METAP1 P53582 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ KLF5 Q13887 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ DCTPP1 Q9H773 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
SCHEMBL16557940 0.96 GRM5 (0.39) GRM5SMN1; SMN2ATMKDM4EALDH1A1
SCHEMBL16455796 0.92 GRM5 (0.43) GRM5SMN1; SMN2ATMKDM4EALDH1A1
SCHEMBL16456256 0.90 GRM5 (0.44) GRM5SMN1; SMN2ATMKDM4EALDH1A1
SCHEMBL16557928 0.90 CYP17A1 (0.38) ATMKDM4ECYP17A1CYP11B1CYP11B2
SCHEMBL16560674 0.90 CYP17A1 (0.38) ATMKDM4ECYP17A1CYP11B1CYP11B2
SCHEMBL16557898 0.90 CYP11B1 (0.38) GRM5CYP17A1CYP11B1CYP11B2TDP2
SCHEMBL16557937 0.89 ALDH1A3 (0.38) SMN1; SMN2KDM4ECYP17A1CYP11B1CYP11B2
SCHEMBL16456250 0.89 GRM5 (0.42) GRM5SMN1; SMN2ATMKDM4EALDH1A1
SCHEMBL16557914 0.89 CA1 (0.38) ATMKDM4ECYP17A1CYP11B1CYP11B2
SCHEMBL16557890 0.89 CA1 (0.38) ATMKDM4ECYP17A1CYP11B1CYP11B2

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-9583715-B2 Anthracene-based compounds and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 — — US disclosed
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
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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