SCHEMBL16604622

SCHEMBL16604622

c1ccc(-c2nc3cc(-c4ccc(-c5ccc6c7c5ccc5cccc(c57)n6-c5ccccc5)cc4)ccc3n2-c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ SIRT2 Q8IXJ6 2/20 0.39
▸ SIRT1 Q96EB6 2/20 0.39
▸ PTGER4 P35408 1/20 0.39
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ GRIA1 P42261 1/20 0.37
▸ CACNG8 Q8WXS5 1/20 0.37
▸ CACNG2 Q9Y698 1/20 0.37
▸ GAA P10253 2/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ RECQL P46063 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ LMNA P02545 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
SCHEMBL16604620 1.00 ESR1 (0.42) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604635 0.93 ESR1 (0.51) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604641 0.92 MDM2 (0.42) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604618 0.92 ESR1 (0.48) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604592 0.91 ESR1 (0.52) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604630 0.91 ESR2 (0.52) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL16604640 0.91 ESR1 (0.42) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604596 0.91 ESR1 (0.48) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604619 0.91 ESR1 (0.45) ESR1ESR2SIRT2SIRT1PTGER4
SCHEMBL16604623 0.91 HDAC1 (0.43) PTGER4MEN1KMT2AMAPTHDAC1

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-9461261-B2 Organic compounds and organic light-emitting devices including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-04 — — US disclosed
US-9461261-B2 Organic compounds and organic light-emitting devices including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-04 — — US disclosed
US-20150090963-A1 ORGANIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-02 — — US disclosed
US-20150090963-A1 ORGANIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-02 — — US disclosed
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