SCHEMBL3363813

SCHEMBL3363813

CCCCCCCCS(=O)(=O)[O-].COCCOC1CC[S+](c2cccc3ccccc23)C1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
MCHR1 Q99705 1/20 0.30

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
SCHEMBL6398679 0.94 KDM4E (0.34) KDM4EALDH1A1RXFP1HRH3CNR1
SCHEMBL6399812 0.92 KDM4E (0.33) KDM4EALDH1A1RXFP1MCHR1
SCHEMBL6399777 0.91 KDM4E (0.34) KDM4EALDH1A1RXFP1HRH3CNR1
SCHEMBL6394293 0.90 KDM4E (0.37) KDM4EALDH1A1RXFP1CNR1CNR2
SCHEMBL6393344 0.87 APLNR (0.33) KDM4EALDH1A1RXFP1CNR1CNR2
SCHEMBL6393536 0.87 KDM4E (0.32) KDM4EALDH1A1RXFP1MCHR1
SCHEMBL6392402 0.85 KDM4E (0.33) KDM4EALDH1A1RXFP1
SCHEMBL3365940 0.85 KDM4E (0.37) KDM4EALDH1A1RXFP1CNR1CNR2
Trifluoromethanesulfonic Acid SCHEMBL2745921 0.84 ACHE (0.31)
SCHEMBL3367546 0.83 CNR1 (0.33) KDM4EALDH1A1RXFP1CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1164434-B1 Radiation-sensitive resin composition JSR CORP (JP) 2010-10-06 EP disclosed
US-6964840-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-11-15 US disclosed
US-20040241580-A1 Radiation-sensitive resin composition NISHIMURA YUKIO (JP) 2004-12-02 US disclosed
US-6800414-B2 FLUOROPOLYMER JSR CORPORATION (JP) 2004-10-05 US disclosed
US-20020009668-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-01-24 US disclosed
EP-1164434-A2 Radiation-sensitive resin composition JSR Corporation (JP) 2001-12-19 EP disclosed