SCHEMBL2921507

SCHEMBL2921507

CN(/N=C/c1cc[n+](CCC[n+]2ccc(/C=N/N(C)c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.47
▸ MEN1 O00255 10/20 0.46
▸ KMT2A Q03164 10/20 0.46
▸ MAPT P10636 9/20 0.46
▸ SMN1; SMN2 Q16637 6/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ HPGD P15428 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ TDP1 Q9NUW8 3/20 0.45
▸ ALOX12 P18054 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ MAPK1 P28482 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ MCL1 Q07820 1/20 0.41
▸ HSP90AA1 P07900 2/20 0.41
▸ APAF1 O14727 1/20 0.41

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
SCHEMBL2921302 1.00 ACHE (0.47) ACHEMEN1KMT2AMAPTSMN1; SMN2
Bromide SCHEMBL2914570 0.98 ACHE (0.50) ACHEMEN1KMT2AMAPTSMN1; SMN2
Bromide SCHEMBL2919575 0.98 ACHE (0.50) ACHEMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2920143 0.97 MEN1 (0.46) ACHEMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2920142 0.97 MEN1 (0.46) ACHEMEN1KMT2AMAPTSMN1; SMN2
Bromide SCHEMBL2923013 0.95 MAPT (0.47) ACHEMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL3024010 0.95 MEN1 (0.47) ACHEMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2920802 0.95 MEN1 (0.47) ACHEMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2920805 0.95 MEN1 (0.47) ACHEMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL3024008 0.95 MEN1 (0.47) ACHEMEN1KMT2AMAPTSMN1; SMN2

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
EP-1647548-A1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff L'OREAL S.A. (FR) 2006-04-19 — — EP claimed
EP-1647548-B1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff OREAL (FR) 2010-08-25 — — EP disclosed
US-7410506-B2 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2008-08-12 — — US disclosed
EP-1647548-A1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff L'OREAL S.A. (FR) 2006-04-19 — — EP disclosed
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