SCHEMBL6723372

SCHEMBL6723372

CCCCCCC(=O)C[S+]1CCOCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.31
CES1 P23141 5/20 0.31
CES2 O00748 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HAO1 Q9UJM8 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
SCHEMBL6723165 0.99 FAAH (0.32) FAAHCES1CES2MEN1CYP1A2
SCHEMBL6730639 0.99 FAAH (0.30) FAAH
SCHEMBL6727890 0.98 FAAH (0.31) FAAHCES1CES2MEN1CYP1A2
SCHEMBL6726352 0.96 CA1 (0.30)
SCHEMBL6728653 0.94
SCHEMBL6735592 0.91 CA1 (0.31)
SCHEMBL6549346 0.90 FAAH (0.33) FAAHCES1CES2MEN1CYP1A2
SCHEMBL6727860 0.90
SCHEMBL6549457 0.89 FAAH (0.33) FAAHCES1CES2MEN1CYP1A2
SCHEMBL6550704 0.89 FAAH (0.32) FAAHCES1CES2MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040224251-A1 Positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-11 US disclosed