SCHEMBL8778738

SCHEMBL8778738

CCCS(=O)(=O)C(O)CC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.32
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CA2 P00918 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
SCHEMBL8778761 0.85 CA2 (0.41) FAAHCA2
SCHEMBL8778745 0.83 CA2 (0.48) FAAHCA2
SCHEMBL8778815 0.81 CA2 (0.52) FAAHCA2
SCHEMBL8778796 0.81 CA2 (0.52) FAAHCA2
SCHEMBL8778779 0.81 CA2 (0.52) FAAHCA2
SCHEMBL8778802 0.81 CA2 (0.52) FAAHCA2
SCHEMBL8778767 0.81 CA2 (0.52) FAAHCA2
SCHEMBL7052849 0.80
SCHEMBL11353915 0.80
SCHEMBL11346519 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US claimed
EP-0602914-B1 Ink compositions for ink jet printing XEROX CORP (US) 1997-11-12 EP disclosed
EP-0602914-A1 Ink compositions for ink jet printing XEROX CORPORATION (US) 1994-06-22 EP disclosed
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US disclosed