SCHEMBL7816299

SCHEMBL7816299

N=C1NC(=N)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
CYP3A4 P08684 2/20 0.59
PTPRC P08575 3/20 0.55
S100A4 P26447 2/20 0.55
ALDH1A1 P00352 2/20 0.55
CA9 Q16790 2/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
CAPN9 O14815 1/20 0.50
CASP3 P42574 1/20 0.50
MAPT P10636 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MCL1 Q07820 1/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
CES1 P23141 1/20 0.49
TSHR P16473 3/20 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
SCHEMBL29546694 1.00 TDP1 (0.59) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL3134182 0.87 TDP1 (0.74) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL8621882 0.75 CYP3A4 (0.43) TDP1CYP3A4ALDH1A1MAPTMEN1
SCHEMBL151957 0.74 CYP3A4 (1.00) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL7830916 0.74 TDP1 (0.47) TDP1CYP3A4PTPRCS100A4ALDH1A1
Methane SCHEMBL28326322 0.73 CYP3A4 (0.96) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL27798142 0.73 CYP3A4 (0.96) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL8918874 0.72 TDP1 (0.45) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL13083518 0.72 CAPN9 (0.71) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL435495 0.71 PTPRC (0.85) TDP1CYP3A4PTPRCS100A4ALDH1A1

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
CN-112442284-B Isoindoline pigment and method for producing same 住友化学株式会社 2023-03-24 CN disclosed
CN-112521774-B Isoindoline pigment and method for producing same 住友化学株式会社 2022-07-08 CN disclosed
US-20220213324-A1 COLORING COMPOSITION CONTAINING ISOINDOLINE COMPOUND AND USE OF SAME TOYO INK SC HOLDINGS CO., LTD. (JP) 2022-07-07 US disclosed
CN-108690372-B Isoindoline pigment and method for producing same 住友化学株式会社 2022-04-15 CN disclosed
EP-3960824-A1 COLORING COMPOSITION CONTAINING ISOINDOLINE COMPOUND AND USE OF SAME Toyo Ink SC Holdings Co., Ltd. (JP) 2022-03-02 EP disclosed
CN-113710758-A Coloring composition containing isoindoline compound and use thereof 东洋油墨SC控股株式会社 2021-11-26 CN disclosed
CN-112521774-A Isoindoline pigment and method for producing same 住友化学株式会社 2021-03-19 CN disclosed
CN-112442284-A Isoindoline pigment and method for producing same 住友化学株式会社 2021-03-05 CN disclosed
WO-2020218262-A1 COLORING COMPOSITION CONTAINING ISOINDOLINE COMPOUND AND USE OF SAME 東洋インキSCホールディングス株式会社 2020-10-29 WO disclosed
CN-108690372-A Isoindoline pigment and method for producing same 住友化学株式会社 2018-10-23 CN disclosed
US-20080182984-A1 METHOD FOR PRODUCING A PIGMENT CANON KABUSHIKI KAISHA (JP) 2008-07-31 US disclosed
EP-0679640-B1 Carboxylate and heat-sensitive recording material using same MITSUI CHEMICALS INC (JP) 2001-08-08 EP disclosed
US-5804529-A HEAT SENSITIVE RECORDING LAYER; BETWEEN TWO POLYMERIC OXYGEN BARRIER LAYERS MITSUBISHI PAPER MILLS LTD. (JP) 1998-09-08 US disclosed
US-5756247-A PHOTOCONDUCTOR OBTAINED BY HYDROXYLATION WITH ACID PASTING GALLIUM PHTHALOCYANINE; CHARGEABILITY, IMAGE; SEMICONDUCTOR LASER PRINTER FUJI XEROX CO., LTD. (JP) 1998-05-26 US disclosed
US-5691272-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-11-25 US disclosed
US-5663327-A Hydroxygallium phthalocyanine crystal, process for producing the same, and electrophotographic photoreceptor containing the same FUJI XEROX CO., LTD. (JP) 1997-09-02 US disclosed
US-5559247-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-24 US disclosed
EP-0679640-A1 Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-11-02 EP disclosed
US-5342490-A Measuring potential produced from oxidizable sulfur compound and coating on electrode of metal porphyrins Lever, Alfred B. P. (CA) 1994-08-30 US disclosed
US-4116959-A ISOINDOLINE PIGMENTS CIBA-GEIGY CORPORATION (US) 1978-09-26 US disclosed