SCHEMBL17573728

SCHEMBL17573728

c1ccc(-c2ccc(Nc3ccc(-c4ccc(Nc5cccc(-c6ccccc6)c5)c(-c5ccccc5)c4)cc3-c3ccccc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.49
▸ SIRT1 Q96EB6 1/20 0.49
▸ MEN1 O00255 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ ALK Q9UM73 2/20 0.45
▸ AR P10275 1/20 0.45
▸ AKR1C3 P42330 2/20 0.43
▸ MGLL Q99685 1/20 0.43
▸ CNR1 P21554 3/20 0.42
▸ TDP1 Q9NUW8 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ PTGER4 P35408 1/20 0.40

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
SCHEMBL17661491 0.98 SIRT2 (0.50) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL15713487 0.96 SIRT2 (0.51) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL17464108 0.96 SIRT2 (0.51) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL17661359 0.95 ALK (0.49) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL17547231 0.93 ALK (0.44) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL17454690 0.93 ALK (0.44) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL14877562 0.93 ALK (0.44) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL17661457 0.93 ALK (0.47) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL20484337 0.93 ALK (0.46) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL22435802 0.93 ALK (0.46) SIRT2SIRT1MEN1MAPTKMT2A

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
WO-2016052835-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-04-07 — — WO disclosed
WO-2016036171-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICES COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-03-10 — — WO disclosed
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