SCHEMBL16893175

SCHEMBL16893175

Cc1ccc(S(=O)(=O)O)c(CC2C=CCO2)c1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.31

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
SCHEMBL537494 0.85 KMT2A (0.38) RAPGEF4
SCHEMBL909187 0.85 KMT2A (0.38) RAPGEF4
SCHEMBL909752 0.85 KMT2A (0.38) RAPGEF4
SCHEMBL5153705 0.80 ALDH1A1 (0.33) RAPGEF4
SCHEMBL27206070 0.80 KDM4E (0.39)
SCHEMBL3812470 0.79 MEN1 (0.34) RAPGEF4
SCHEMBL3809686 0.79 MEN1 (0.34) RAPGEF4
SCHEMBL20184269 0.78 ALDH1A1 (0.44)
SCHEMBL32681961 0.78 SLC6A2 (0.37)
SCHEMBL2484468 0.76 KDM4E (0.46)

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
EP-2240491-B1 TETRAHYDROFURO(2,3-b)PYRROL-3-ONE DERIVATIVES AS INHIBITORS OF CYSTEINE PROTEINASES AMURA THERAPEUTICS LTD (GB) 2015-07-15 EP disclosed