SCHEMBL21623614

SCHEMBL21623614

c1ccc(-c2nc(-c3ccc(-c4cccc(-c5ccc(-c6cc(-c7ccccn7)nc(-c7ccccc7)n6)cc5)c4)cc3)cc(-c3ccccn3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ HPGD P15428 4/20 0.53
▸ NTSR1 P30989 1/20 0.53
▸ KDM4E B2RXH2 6/20 0.50
▸ LMNA P02545 5/20 0.50
▸ GLA P06280 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ RAB9A P51151 4/20 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
▸ CCR1 P32246 3/20 0.48
▸ CCR5 P51681 3/20 0.48
▸ CCR8 P51685 3/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48

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
SCHEMBL18680024 0.94 MEN1 (0.49) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17945817 0.94 MEN1 (0.54) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL18679999 0.92 KDM4E (0.49) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22309744 0.92 KDM4E (0.52) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19009531 0.92 MEN1 (0.51) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL18698104 0.92 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24626675 0.92 MEN1 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24626713 0.92 KDM4E (0.49) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24626438 0.92 KDM4E (0.49) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24626349 0.92 KDM4E (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020012685-A1 THIN FILM, ELECTRONIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE, DISPLAY DEVICE, AND LIGHTING EQUIPMENT コニカミノルタ株式会社 2020-01-16 — — WO disclosed
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