SCHEMBL6854532

SCHEMBL6854532

CCN(Cc1ccccc1)c1cc(S(=O)(=O)O)ccc1C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.48
CNR1 P21554 7/20 0.48
TSHR P16473 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
NR3C1 P04150 1/20 0.43
S1PR1 P21453 2/20 0.42
THRB P10828 1/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42

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
SCHEMBL6850443 0.85 ALDH1A1 (0.38) CNR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL14419254 0.82 NR3C1 (0.49) KMT2ANR3C1TRPM8
SCHEMBL9717458 0.81 TSHR (0.64) CNR2CNR1TSHR
SCHEMBL7888440 0.81 TSHR (0.58) CNR2CNR1TSHRMEN1KMT2A
SCHEMBL5624047 0.81 NR3C1 (0.48) KMT2ANR3C1TRPM8
SCHEMBL11654490 0.79 KMT2A (0.48) CNR2CNR1TSHRMEN1KMT2A
SCHEMBL2112571 0.79 TSHR (0.64) CNR2CNR1TSHR
SCHEMBL735955 0.78 TSHR (0.58) CNR2CNR1TSHRMEN1KMT2A
SCHEMBL10657987 0.77 TSHR (0.49) CNR2CNR1TSHRLMNANR3C1
SCHEMBL9678984 0.76 TSHR (0.40) CNR2CNR1TSHRMEN1KMT2A

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108779356-B Printing ink 富士胶片株式会社 2021-07-02 CN disclosed
US-10544318-B2 Inks FUJIFILM CORPORATION (JP) 2020-01-28 US disclosed
EP-3430097-B1 INKS FUJIFILM CORP (JP) 2019-10-30 EP disclosed
EP-3430097-A1 INKS FUJIFILM Corporation (JP) 2019-01-23 EP disclosed
US-20190016910-A1 INKS FUJIFILM CORPORATION (JP) 2019-01-17 US disclosed
CN-108779356-A ink 富士胶片株式会社 2018-11-09 CN disclosed
WO-2018198887-A1 INKS FUJIFILM CORPORATION (JP) 2018-11-01 WO disclosed
WO-2017159551-A1 INKS FUJIFILM CORPORATION (JP) 2017-09-21 WO disclosed
US-6780229-B2 COMPOSITION COMPRISING COLORANT, SULFANILIC ACID DERIVATIVE, ORGANIC SOLVENT, HYDROTROPIC AGENT, BIOCIDE, SURFACTANT AND WATER; INK JET PRINTING INK AVECIA LIMITED (GB) 2004-08-24 US disclosed
EP-1263899-B1 INKS AVECIA LTD (GB) 2003-12-17 EP disclosed
US-20030116058-A1 Inks AVECIA INKJET LIMITED (GB) 2003-06-26 US disclosed
EP-1263899-A2 INKS Avecia Limited (GB) 2002-12-11 EP disclosed
WO-2001062859-A2 INKS AVECIA LIMITED (GB) 2001-08-30 WO disclosed
EP-0130711-B1 AQUEOUS SOLUTIONS OF REACTIVE DYES ICI AMERICAS INC. (US) 1987-02-11 EP disclosed
EP-0130711-A2 Aqueous solutions of reactive dyes ICI AMERICAS INC. (US) 1985-01-09 EP disclosed
US-4472168-A STORAGE STABILITY BUFFERED SOLUTIONS ICI AMERICAS INC. (US) 1984-09-18 US disclosed