SCHEMBL4397430

SCHEMBL4397430

Nc1c(OC(=O)O)ccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.68
MAPT P10636 9/20 0.62
MEN1 O00255 8/20 0.62
KMT2A Q03164 8/20 0.62
MAPK1 P28482 7/20 0.62
ALDH1A1 P00352 7/20 0.62
POLB P06746 4/20 0.62
THRB P10828 4/20 0.62
LMNA P02545 2/20 0.62
RECQL P46063 2/20 0.62
L3MBTL1 Q9Y468 3/20 0.58
MCL1 Q07820 3/20 0.58
NPSR1 Q6W5P4 3/20 0.58
PKM P14618 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
MAOA P21397 3/20 0.57
MAOB P27338 1/20 0.57
SMN1; SMN2 Q16637 5/20 0.54
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54

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
SCHEMBL8777916 0.87 ADORA2A (0.63) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL9509808 0.86 ADORA2A (0.61) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL8777904 0.84 ADORA2A (0.60) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL5306728 0.83 MAPT (0.57) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL8769865 0.83 MAPT (0.49) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL23212346 0.81 TTR (0.57) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL11345777 0.81 MEN1 (0.61) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL11131456 0.81 MEN1 (0.64) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL9751849 0.80 RAB9A (0.68) ADORA2AMAPTMEN1KMT2AMAPK1
SCHEMBL9510439 0.79 CYP1A1 (0.49) ADORA2AMAPTMEN1KMT2AMAPK1

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1731580-B1 POLLUTION-FREE RUSTPROOF PIGMENT COMPOSITION DAINIPPON TORYO KK (JP) 2009-12-23 EP claimed
EP-0046863-B1 PROCESS FOR THE PREPARATION OF 1-AMINOANTHRAQUINONE-2-CARBOXYLIC ACID BASF Aktiengesellschaft (DE) 1983-06-29 EP claimed
EP-0046863-A1 Process for the preparation of 1-aminoanthraquinone-2-carboxylic acid BASF Aktiengesellschaft (DE) 1982-03-10 EP claimed
EP-0585873-B1 Method of preparing disazo pigments CLARIANT GMBH (DE) 1997-12-29 EP disclosed
EP-0518909-B1 WATER-INSOLUBLE AZO DYES, THEIR MANUFACTURE AND USE HOECHST AG (DE) 1994-05-25 EP disclosed
EP-0585873-A1 Method of preparing disazo pigments HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-09 EP disclosed
EP-0382053-B1 PROCESS FOR THE PREPARATION OF ANTHRAQUINONE DERIVATIVES BASF Aktiengesellschaft (DE) 1993-09-22 EP disclosed
EP-0518909-A1 WATER-INSOLUBLE AZO DYES, THEIR MANUFACTURE AND USE. HOECHST AG (DE) 1992-12-23 EP disclosed
EP-0316649-B1 WATER INSOLUBLE AZO COLOURING AGENTS, THEIR PREPARATION AND USE HOECHST AKTIENGESELLSCHAFT (DE) 1992-07-22 EP disclosed
EP-0326866-B1 PROCESS FOR THE PREPARATION OF ARYL AMINE OF THE ANTHRAQUINONE SERIES BASF Aktiengesellschaft (DE) 1992-01-02 EP disclosed
WO-1991013941-A1 WATER-INSOLUBLE AZO DYES, THEIR MANUFACTURE AND USE HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-19 WO disclosed
EP-0023617-A1 Anthraquinone-azo compounds, process for their preparation and their use as pigments BAYER AG (DE) 1981-02-11 EP disclosed
EP-0023666-A1 Anthraquinone-azomethine compounds, process for their preparation as well as a process for pigmenting organic macromolecular materials BAYER AG (DE) 1981-02-11 EP disclosed
EP-0023648-A1 Anthraquinone-azomethine compounds, process for their preparation; process for dyeing synthetic fibre materials as well as for pigmenting organic macromolecular materials BAYER AG (DE) 1981-02-11 EP disclosed
EP-0018538-A2 Anthraquinone derivatives, process for their preparation, process for the pigmentation of organic macromolecular materials and pigmented organic macromolecular material BAYER AG (DE) 1980-11-12 EP disclosed
EP-0015479-A1 Thermally stable crosslinked polymers, their application, and solutions or mixtures containing them, with their application BAYER AG (DE) 1980-09-17 EP disclosed
EP-0012379-A1 Laquer mixture and coating material containing polyamide hydantoins BAYER AG (DE) 1980-06-25 EP disclosed
EP-0012381-A1 Process for the preparation of compounds containing hydantoin groups BAYER AG (DE) 1980-06-25 EP disclosed
EP-0008627-A2 Quinazoline derivatives, azo dyes derived from the quinazolines and their use as pigments BAYER AG (DE) 1980-03-19 EP disclosed
EP-0008063-A1 Azomethine derivatives of anthraquinones, methods for their preparation, their use in the pigmentation of organic macromolecular compounds and the materials thus obtained BAYER AG (DE) 1980-02-20 EP disclosed