SCHEMBL22475377

SCHEMBL22475377

Cc1cc(I)cc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)c(Cl)c2)c1O

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 15/20 0.80
MEN1 O00255 1/20 0.80
HSPD1 P10809 1/20 0.80
PIK3CA P42336 1/20 0.80
HTT P42858 1/20 0.80
BLM P54132 1/20 0.80
HSPE1 P61604 1/20 0.80
KMT2A Q03164 1/20 0.80
STK39 Q9UEW8 5/20 0.69
PARG Q86W56 2/20 0.66

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
Rafoxanide SCHEMBL29422184 0.89 PNLIP (1.00) PNLIPMEN1HSPD1PIK3CAHTT
Rafoxanide SCHEMBL118031 0.89 PNLIP (1.00) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL21776165 0.89 PNLIP (0.72) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL23685897 0.85 PNLIP (0.80) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL20413308 0.85 PNLIP (0.84) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL19868350 0.84 PARG (0.76) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL13164679 0.82 ESRRA (0.61) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL21579434 0.81 PNLIP (0.84) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL20844337 0.81 PNLIP (0.84) PNLIPMEN1HSPD1PIK3CAHTT
SCHEMBL21579433 0.81 PNLIP (0.84) PNLIPMEN1HSPD1PIK3CAHTT

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-3715342-A1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2020-09-30 EP disclosed