SCHEMBL7160641

SCHEMBL7160641

CCCCS(=O)(=O)[O-].C[S+](CC(=O)C1CCCC1)C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.35
KMT2A Q03164 1/20 0.30
EPHX2 P34913 1/20 0.30
ENPP3 O14638 1/20 0.30
ENPP1 P22413 1/20 0.30
ENPP2 Q13822 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
SCHEMBL7160025 1.00 NAAA (0.35) NAAAKMT2AEPHX2ENPP3ENPP1
SCHEMBL6550966 0.88 NAAA (0.37) NAAAKMT2AEPHX2ENPP3ENPP1
SCHEMBL6549177 0.86 EPHX2 (0.32) NAAAEPHX2
SCHEMBL6550460 0.86 NAAA (0.35) NAAAKMT2AEPHX2
SCHEMBL6551148 0.85 EPHX2 (0.31) NAAAEPHX2
SCHEMBL6549856 0.84 NAAA (0.32) NAAAEPHX2
SCHEMBL6549709 0.84 NAAA (0.32) NAAAKMT2AEPHX2
SCHEMBL6549501 0.84 NAAA (0.36) NAAAKMT2AEPHX2ENPP3ENPP1
SCHEMBL7160437 0.83 ALDH1A1 (0.31)
SCHEMBL6549413 0.83 MMP1 (0.32)

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-6548220-B2 Containing acid generator SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 US disclosed