SCHEMBL7159409

SCHEMBL7159409

CCC(=O)C[S+]1CCOCC1.CCCCS(=O)(=O)[O-]

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 1/20 0.30
ADAM17 P78536 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
SCHEMBL7165271 0.94 EPHX2 (0.39) EPHX2
SCHEMBL7163299 0.90 CES2 (0.32) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL7158447 0.90 EPHX2 (0.32) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL7164340 0.89 CES2 (0.33) EPHX2
SCHEMBL7155902 0.88 HAO1 (0.36) EPHX2
SCHEMBL7159585 0.87 EPHX2 (0.32) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL7160023 0.87 MMP1 (0.33) EPHX2LMNAPOLBSMN1; SMN2MMP1
SCHEMBL6550551 0.87 EPHX2 (0.34) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL6550943 0.85 EPHX2 (0.33) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL7161126 0.85 EPHX2 (0.38) EPHX2

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