SCHEMBL20173626

SCHEMBL20173626

CN(C1=C(/C=C/C2=[N+](CCCCS(=O)(=O)[O-])c3ccc4ccccc4c3C2(C)C)c2ccccc2/C1=C\C=C1\N(CCCCS(=O)(=O)O)c2ccc3ccccc3c2C1(C)C)S(=O)(=O)C(F)(F)F

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.66
CHRM3 P20309 4/20 0.66
HRH2 P25021 3/20 0.66
MLNR O43193 1/20 0.66
NR1I2 O75469 1/20 0.66
PGR P06401 1/20 0.66
ADRB1 P08588 1/20 0.66
ADORA3 P0DMS8 1/20 0.66
DRD2 P14416 1/20 0.66
ADRA2B P18089 1/20 0.66
ADRA2C P18825 1/20 0.66
CNR1 P21554 1/20 0.66
DRD1 P21728 1/20 0.66
TBXA2R P21731 1/20 0.66
SLC6A2 P23975 1/20 0.66
HTR2C P28335 1/20 0.66
BDKRB2 P30411 1/20 0.66
ADORA1 P30542 1/20 0.66
AGTR1 P30556 1/20 0.66
SLC6A4 P31645 1/20 0.66

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
SCHEMBL24305644 1.00 CHRM1 (0.66) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL24147889 0.97 CHRM1 (0.62) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL20412037 0.97 CHRM1 (0.61) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL25543418 0.94 CHRM1 (0.58) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL25893282 0.94 MLNR (0.56) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL24050326 0.94 CHRM1 (0.57) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL26011246 0.92 BLM (0.56) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL26011402 0.91 MLNR (0.54) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL821165 0.90 PRMT1 (0.56) CHRM1CHRM3HRH2MLNRNR1I2
SCHEMBL23795056 0.89 BLM (0.52) CHRM1CHRM3HRH2MLNRNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240227382-A1 A Lithographic Printing Plate Precursor ECO3 BV (BE) 2024-07-11 US disclosed
US-11813838-B2 Lithographic printing plate precursor AGFA OFFSET BV (BE) 2023-11-14 US disclosed
US-11813838-B2 Lithographic printing plate precursor AGFA OFFSET BV (BE) 2023-11-14 US disclosed
US-20230350291-A1 A Lithographic Printing Plate Precursor AGFA OFFSET BV (BE) 2023-11-02 US disclosed
US-20230311474-A1 A Lithographic Printing Plate Precursor AGFA OFFSET BV (BE) 2023-10-05 US disclosed
US-20230266667-A1 A Lithographic Printing Plate Precursor AGFA OFFSET BV (BE) 2023-08-24 US disclosed
WO-2023148114-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR ECO3 (BE) 2023-08-10 WO disclosed
EP-4223534-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA OFFSET BV (BE) 2023-08-09 EP disclosed
EP-3793829-B1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA OFFSET BV (BE) 2023-07-12 EP disclosed
US-20230158792-A1 A Lithographic Printing Plate Precursor AGFA OFFSET BV (BE) 2023-05-25 US disclosed
WO-2021175571-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA NV (BE) 2021-09-10 WO disclosed
US-20210221160-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA NV (BE) 2021-07-22 US disclosed
US-20210187935-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR ECO3 BV (BE) 2021-06-24 US disclosed
US-20210129517-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA NV (BE) 2021-05-06 US disclosed
US-10632734-B2 Lithographic printing plate precursor comprising graphite oxide AGFA NV (BE) 2020-04-28 US disclosed
US-20180215621-A1 COMPOSITION COMPRISING GRAPHITE OXIDE AND AN INFRARED ABSORBING COMPOUND AGFA NV (BE) 2018-08-02 US disclosed
US-20180207925-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR COMPRISING GRAPHITE OXIDE AGFA NV (BE) 2018-07-26 US disclosed
US-20180207925-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR COMPRISING GRAPHITE OXIDE AGFA NV (BE) 2018-07-26 US disclosed
US-20180147874-A1 LASER MARKABLE MATERIALS AND DOCUMENTS AGFA-GEVAERT (BE) 2018-05-31 US disclosed
US-20180141364-A1 LASER MARKABLE COMPOSITIONS, MATERIALS AND DOCUMENTS AGFA-GEVAERT (BE) 2018-05-24 US disclosed