SCHEMBL5207316

SCHEMBL5207316

Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CSc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2OC(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.48
TP53 P04637 5/20 0.48
PPARG P37231 3/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 3/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL5299157 0.94 MAPT (0.44) MAPTTP53PPARGPPARA
SCHEMBL5206201 0.93 MAPT (0.42) MAPTTP53POLB
SCHEMBL5285784 0.92 MAPT (0.42) MAPTTP53PPARGPPARAPOLB
SCHEMBL2522432 0.89 MAPT (0.49) MAPTTP53PPARGPPARDPPARA
SCHEMBL2522434 0.89 MAPT (0.49) MAPTTP53PPARGPPARDPPARA
SCHEMBL2917013 0.88 TP53 (0.46) MAPTTP53PPARGPPARDPPARA
SCHEMBL2521631 0.83 MAPT (0.45) MAPTTP53PPARGPPARAPOLB
SCHEMBL2521633 0.83 MAPT (0.45) MAPTTP53PPARGPPARAPOLB
SCHEMBL5206559 0.82 MAPT (0.46) MAPTTP53PPARGPPARDPPARA
SCHEMBL5206326 0.81 PPARA (0.44) MAPTTP53PPARGPPARA

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-1448523-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE NOVARTIS AG (CH) 2007-08-22 EP claimed