SCHEMBL7163299

SCHEMBL7163299

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

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
EPHX2 P34913 1/20 0.32
RAB9A P51151 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7164340 0.96 CES2 (0.33) CES2CES1EPHX2
SCHEMBL7155902 0.95 HAO1 (0.36) CES2CES1EPHX2
SCHEMBL7155891 0.95 EPHX2 (0.38) CES2CES1EPHX2
SCHEMBL7158447 0.94 EPHX2 (0.32) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL7161126 0.92 EPHX2 (0.38) CES2CES1EPHX2
SCHEMBL7163894 0.92 EPHX2 (0.38) CES2CES1EPHX2
SCHEMBL7159409 0.90 EPHX2 (0.32) EPHX2LMNAPOLBSMN1; SMN2
SCHEMBL7159603 0.89 EPHX2 (0.38) CES2CES1EPHX2
SCHEMBL6550408 0.87 CES1 (0.34) CES2CES1EPHX2RAB9ALMNA
SCHEMBL6731317 0.87 CES1 (0.37) CES2CES1LMNAPOLBSMN1; SMN2

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