SCHEMBL582033

SCHEMBL582033

Nc1c(Cl)cc(Cl)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.72
CYP1A2 P05177 1/20 0.72
ADORA2A P29274 4/20 0.59
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
TDP1 Q9NUW8 4/20 0.53
MAPT P10636 3/20 0.53
POLB P06746 3/20 0.53
MAOA P21397 2/20 0.50
CSNK1A1 P48729 2/20 0.50
CSNK1D P48730 2/20 0.50
CSNK1G1 Q9HCP0 2/20 0.50
FGR P09769 1/20 0.50
PIM1 P11309 1/20 0.50
DYRK1A Q13627 1/20 0.50
HIPK2 Q9H2X6 1/20 0.50
MAPK1 P28482 4/20 0.47
MCL1 Q07820 3/20 0.47
THRB P10828 2/20 0.47
PKM P14618 2/20 0.47

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
SCHEMBL7769609 0.87 ADORA2A (0.62) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL27749669 0.87 CYP1A1 (0.70) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL3581453 0.84 CYP1A1 (1.00) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL9619249 0.84 CYP1A1 (0.66) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL6055375 0.84 CYP1A1 (0.57) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL11180975 0.84 FTO (0.59) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL29181058 0.83 CYP1A1 (0.48) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL28146955 0.82 MAOA (0.58) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL11333584 0.82 CYP1A1 (0.49) CYP1A1CYP1A2ADORA2AMEN1KMT2A
SCHEMBL6905734 0.80 CYP1A1 (0.56) CYP1A1CYP1A2ADORA2AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0250362-B1 PROCESS FOR THE PREPARATION OF A MIXTURE OF 1-AMINO-2-CHLORO-4-HYDROXY-ANTHRAQUINONE AND 1-AMINO-2-BROMO-4-HYDROXY-ANTHRAQUINONE CIBA-GEIGY AG (CH) 1992-01-02 EP claimed
US-4767573-A Process for the preparation of a mixture of 1-amino-2-chloro-4-hydroxyanthraquinone and 1-amino-2-bromo-4-hydroxyanthraquinone CIBA-GEIGY CORPORATION (US) 1988-08-30 US claimed
EP-0250362-A1 Process for the preparation of a mixture of 1-amino-2-chloro-4-hydroxy-anthraquinone and 1-amino-2-bromo-4-hydroxy-anthraquinone CIBA-GEIGY AG (CH) 1987-12-23 EP claimed
US-4261909-A Process for the reductive removal of halogen atoms from anthraquinones CIBA-GEIGY AG (CH) 1981-04-14 US claimed
EP-2895561-B1 INKS AND A PROCESS FOR INK-JET PRINTING TEXTILE FIBRE MATERIALS HUNTSMAN ADVANCED MAT (SWITZERLAND) GMBH (CH) 2017-09-20 EP disclosed
EP-1487920-B1 ANTHRAQUINONE DYES HUNTSMAN ADV MAT SWITZERLAND (CH) 2012-02-15 EP disclosed
US-7456316-B2 Anthraquinone dyes HUNTSMAN INTERNATIONAL LLC (US) 2008-11-25 US disclosed
US-20050150061-A1 Anthraquinone dyes HUNTSMAN INTERNATIONAL LLC 2005-07-14 US disclosed
EP-1487920-A1 ANTHRAQUINONE DYES Ciba SC Holding AG (CH) 2004-12-22 EP disclosed
WO-2003080734-A1 ANTHRAQUINONE DYES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-10-02 WO disclosed
EP-0355586-B1 Anthraquinone dye compounds having fibers reactive group SUMITOMO CHEMICAL CO (JP) 1995-04-05 EP disclosed
EP-0353031-B1 Anthrapyridone compounds and their production process SUMITOMO CHEMICAL CO (JP) 1995-03-22 EP disclosed
US-4767573-A Process for the preparation of a mixture of 1-amino-2-chloro-4-hydroxyanthraquinone and 1-amino-2-bromo-4-hydroxyanthraquinone CIBA-GEIGY CORPORATION (US) 1988-08-30 US disclosed
EP-0166684-B1 PROCESS FOR THE PREPARATION OF HYDROXY AROMATES CIBA-GEIGY AG (CH) 1988-04-20 EP disclosed
EP-0250362-A1 Process for the preparation of a mixture of 1-amino-2-chloro-4-hydroxy-anthraquinone and 1-amino-2-bromo-4-hydroxy-anthraquinone CIBA-GEIGY AG (CH) 1987-12-23 EP disclosed
US-4657707-A REACTING A HALOGENATED ANTHRAQUINONE, NAPHTHOQUINONE OR PHENOL WITH CONCENTRATED SULFURIC ACID AND AN ALDEHYDE CIBA-GEIGY CORPORATION (US) 1987-04-14 US disclosed
EP-0166684-A1 Process for the preparation of hydroxy aromates CIBA-GEIGY AG (CH) 1986-01-02 EP disclosed
US-4261909-A Process for the reductive removal of halogen atoms from anthraquinones CIBA-GEIGY AG (CH) 1981-04-14 US disclosed
US-4187238-A BLUE DYE FOR POLYESTERS CIBA-GEIGY CORPORATION (US) 1980-02-05 US disclosed
US-4157893-A MONO OR DISAZO DYE CONTAINING AN AMINO-SUBSTITUTED PYRIMIDINE RING BASF AKTIENGESELLSCHAFT (DE) 1979-06-12 US disclosed