SCHEMBL5488348

SCHEMBL5488348

O=C1c2c(O)ccc([N+](=O)[O-])c2C(=O)c2c(O)ccc(Nc3ccccc3)c21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.68
▸ TSHR P16473 2/20 0.68
▸ HIF1A Q16665 2/20 0.68
▸ CYP1A2 P05177 1/20 0.68
▸ CYP2D6 P10635 1/20 0.68
▸ CYP2C9 P11712 1/20 0.68
▸ TP53 P04637 1/20 0.67
▸ HPGD P15428 1/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67
▸ MAPT P10636 4/20 0.62
▸ POLB P06746 2/20 0.62
▸ APEX1 P27695 1/20 0.62
▸ CASP6 P55212 1/20 0.62
▸ CSNK2A2 P19784 1/20 0.58
▸ CSNK2B P67870 1/20 0.58
▸ CSNK2A1 P68400 1/20 0.58
▸ CSNK2A3 Q8NEV1 1/20 0.58
▸ TDP1 Q9NUW8 4/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ MAPK1 P28482 3/20 0.53

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
SCHEMBL11796394 1.00 CYP3A4 (0.68) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL11367014 1.00 CYP3A4 (0.68) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL11037999 1.00 CYP3A4 (0.68) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL29856171 1.00 CYP3A4 (0.68) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL12862803 0.93 CYP3A4 (0.61) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL13658593 0.89 CYP3A4 (0.56) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL11117743 0.89 CYP3A4 (0.72) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL14094934 0.89 CYP3A4 (0.55) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL14094935 0.89 CYP3A4 (0.55) CYP3A4TSHRHIF1ACYP1A2CYP2D6
SCHEMBL1993642 0.89 CYP3A4 (0.72) CYP3A4TSHRHIF1ACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-9371463-B2 Inks and a process for ink-jet printing textile fibre materials HUNTSMAN INTERNATIONAL LLC (US) 2016-06-21 — — US disclosed
US-9371463-B2 Inks and a process for ink-jet printing textile fibre materials HUNTSMAN INTERNATIONAL LLC (US) 2016-06-21 — — US disclosed
US-20150225584-A1 Inks and a Process for Ink-Jet Printing Textile Fibre Materials HUNTSMAN INTERNATIONAL LLC 2015-08-13 — — US disclosed
US-20150225584-A1 Inks and a Process for Ink-Jet Printing Textile Fibre Materials HUNTSMAN INTERNATIONAL LLC 2015-08-13 — — US disclosed
WO-2014040810-A1 INKS AND A PROCESS FOR INK-JET PRINTING TEXTILE FIBRE MATERIALS HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2014-03-20 — — WO disclosed
EP-1354005-B1 AZO DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE DYEING OR PRINTING OF HYDROPHOBIC FIBRE MATERIALS HUNTSMAN ADV MAT SWITZERLAND (CH) 2011-02-23 — — EP disclosed
US-7824451-B2 blue anthraquinone and anthra(2,3-c)pyrrolidinedione pigments; dyeing very fine polyester fibers; also with red and/or yellow pigments DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2010-11-02 — — US disclosed
US-7824451-B2 blue anthraquinone and anthra(2,3-c)pyrrolidinedione pigments; dyeing very fine polyester fibers; also with red and/or yellow pigments DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2010-11-02 — — US disclosed
US-20090263655-A1 DYE MIXTURES HUNTSMAN INTERNATIONAL LLC (US) 2009-10-22 — — US disclosed
US-20070226919-A1 Method for Dyeing or Printing Textile Materials HUNTSMAN INTERNATIONAL LLC (US) 2007-10-04 — — US disclosed
US-20070226919-A1 Method for Dyeing or Printing Textile Materials HUNTSMAN INTERNATIONAL LLC (US) 2007-10-04 — — US disclosed
US-7220465-B2 Liquid crystal composition, anthraquinone compound and liquid crystal device employing the composition FUJIFILM CORPORATION (JP) 2007-05-22 — — US disclosed
EP-0924335-B1 Process for printing textile fibres materials according to the ink-jet printing process HUNTSMAN ADV MAT SWITZERLAND (CH) 2007-03-28 — — EP disclosed
US-20070058014-A1 Process for printing textile fibre materials in accordance with the ink-jet printing process HUNTSMAN INTERNATIONAL LLC 2007-03-15 — — US disclosed
US-20070058014-A1 Process for printing textile fibre materials in accordance with the ink-jet printing process HUNTSMAN INTERNATIONAL LLC 2007-03-15 — — US disclosed
US-7179308-B2 Ethylenically-unsaturated blue anthraquinone dyes EASTMAN CHEMICAL COMPANY (US) 2007-02-20 — — US disclosed
US-7172634-B2 Ethylenically-unsaturated blue anthraquinone dyes EASTMAN CHEMICAL COMPANY (US) 2007-02-06 — — US disclosed
US-20050173673-A1 Liquid crystal composition, anthraquinone compound and liquid crystal device employing the composition FUJI PHOTO FILM CO., LTD. (JP) 2005-08-11 — — US disclosed
US-4294581-A ANTHRAQUINONE DYES BASF AKTIENGESELLSCHAFT (DE) 1981-10-13 — — US disclosed
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