SCHEMBL17945817

SCHEMBL17945817

c1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc(-c5ccccn5)cc4)n3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ ALDH1A1 P00352 5/20 0.54
▸ MAPT P10636 5/20 0.54
▸ HPGD P15428 5/20 0.54
▸ KDM4E B2RXH2 5/20 0.54
▸ LMNA P02545 4/20 0.54
▸ GLA P06280 1/20 0.54
▸ NTSR1 P30989 1/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ TP53 P04637 3/20 0.49
▸ PKM P14618 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ KLF5 Q13887 1/20 0.49
▸ MAOB P27338 3/20 0.47
▸ MAOA P21397 2/20 0.47
▸ DHODH Q02127 1/20 0.47
▸ NPC1 O15118 2/20 0.46

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
SCHEMBL17945610 0.97 MEN1 (0.54) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16305222 0.95 MEN1 (0.49) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19009531 0.95 MEN1 (0.51) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17945602 0.95 KDM4E (0.54) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16305246 0.94 KDM4E (0.48) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL25460598 0.94 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21623614 0.94 MEN1 (0.53) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL2251139 0.93 KDM4E (0.52) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17367805 0.93 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL10070678 0.93 KDM4E (0.53) MEN1KMT2AALDH1A1MAPTHPGD

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-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 — — US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 — — US disclosed
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