SCHEMBL13715977

SCHEMBL13715977

c1ccc(N=Nc2ccc(N=Nc3cccc4ccccc34)c3ccccc23)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.61
▸ KMT2A Q03164 8/20 0.61
▸ TDP1 Q9NUW8 6/20 0.61
▸ MAPK1 P28482 5/20 0.61
▸ L3MBTL1 Q9Y468 4/20 0.61
▸ NPC1 O15118 4/20 0.61
▸ MAPT P10636 3/20 0.61
▸ RAB9A P51151 3/20 0.49
▸ THRB P10828 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.48
▸ GLO1 Q04760 3/20 0.46
▸ CYP3A4 P08684 5/20 0.46
▸ CYP1A2 P05177 3/20 0.46
▸ ADRA2C P18825 2/20 0.46
▸ DRD1 P21728 2/20 0.46
▸ HTR2B P41595 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HBB P68871 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ CYP2C19 P33261 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
SCHEMBL26173197 1.00 MEN1 (0.61) MEN1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL2926928 0.96 MEN1 (0.55) MEN1KMT2ATDP1MAPK1L3MBTL1
Azobenzene SCHEMBL11130609 0.96 MEN1 (0.55) MEN1KMT2ATDP1MAPK1L3MBTL1
Azobenzene SCHEMBL11226032 0.96 MEN1 (0.55) MEN1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL2926925 0.96 MEN1 (0.55) MEN1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL23257776 0.94 MEN1 (0.53) MEN1KMT2ATDP1MAPK1L3MBTL1
Azobenzene SCHEMBL11591260 0.94 MEN1 (0.53) MEN1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL11004070 0.94 MEN1 (0.53) MEN1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL10602978 0.94 MEN1 (0.53) MEN1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL10602984 0.94 MEN1 (0.53) MEN1KMT2ATDP1MAPK1L3MBTL1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193870-B2 Fibre-reactive dyes, their preparation and their use HUNTSMAN INTERNATIONAL LLC (US) 2015-11-24 — — US disclosed
US-20150096131-A1 Fibre-Reactive Dyes, Their Preparation and Their Use HUNTSMAN INTERNATIONAL LLC 2015-04-09 — — US disclosed
US-7572301-B2 Fibre-reactive dyes, their preparation and their use HUNTSMAN INTERNATIONAL LLC (US) 2009-08-11 — — US disclosed
US-7553339-B2 Bringing fiber material into contact with at least one reactive dye containing at least one anionic group, at least one compound which reduces the ionic character of the anionic group, and at least one nucleophilic compound; yields dyeings or prints having deep hues and very good fastness HUNTSMAN INTERNATIONAL LLC (US) 2009-06-30 — — US disclosed
US-20080250575-A1 Fibre-Reactive Dyes, Their Preparation And Their Use HUNTSMAN INTERNATIONAL LLC 2008-10-16 — — US disclosed
US-7396370-B2 Method of dyeing or printing synthetic polyamide fibre materials using reactive dyes HUNTSMAN INTERNATIONAL LLC (US) 2008-07-08 — — US disclosed
US-20070130703-A1 Bringing fiber material into contact with at least one reactive dye containing at least one anionic group, at least one compound which reduces the ionic character of the anionic group, and at least one nucleophilic compound; yields dyeings or prints having deep hues and very good fastness CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-06-14 — — US disclosed
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