SCHEMBL9293171

SCHEMBL9293171

CC(=O)OS(=O)(=O)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.32

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
SCHEMBL28932858 0.83 ALDH1A1 (0.33) ALDH1A1TSHRGAA
SCHEMBL576511 0.76 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL8400145 0.75 ALDH1A1 (0.42) ALDH1A1TSHR
SCHEMBL11583645 0.74 ALDH1A1 (0.30) ALDH1A1TSHRGAA
SCHEMBL9562237 0.74 TSHR (0.38) ALDH1A1TSHR
SCHEMBL576284 0.72
SCHEMBL8402211 0.70 TSHR (0.34) ALDH1A1TSHR
SCHEMBL9292477 0.70 MIF (0.32)
SCHEMBL18126470 0.70 TSHR (0.37) ALDH1A1TSHRGAA
SCHEMBL114520 0.69 ALDH1A1 (0.41) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5329017-A Reduction of cyclopropane acrylic esters, sulfinic acid intermediate ROUSSEL-UCLAF (FR) 1994-07-12 US disclosed
EP-0348254-B1 PROCESS FOR THE PREPARATION OF NORPYRETHROID COMPOUNDS ROUSSEL-UCLAF (FR) 1993-06-23 EP disclosed
EP-0348254-A2 Process for the preparation of norpyrethroid compounds ROUSSEL-UCLAF (FR) 1989-12-27 EP disclosed