SCHEMBL6239522

SCHEMBL6239522

COc1ccc(CC2SC(=O)NC2=O)cc1C(=O)NCc1cccc(C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.59
PPARD Q03181 4/20 0.51
PPARG P37231 4/20 0.49
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ROCK2 O75116 1/20 0.48
ROCK1 Q13464 1/20 0.48
PTPN1 P18031 2/20 0.48
KCNQ3 O43525 1/20 0.47
KCNQ2 O43526 1/20 0.47
PSEN1 P49768 2/20 0.47
PSEN2 P49810 2/20 0.47
APH1B Q8WW43 2/20 0.47
NCSTN Q92542 2/20 0.47
APH1A Q96BI3 2/20 0.47
PSENEN Q9NZ42 2/20 0.47
FFAR1 O14842 1/20 0.46

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
SCHEMBL20125593 0.91 PPARA (0.61) PPARAPPARDPPARGPTPN1PSEN1
SCHEMBL14379043 0.91 PPARA (0.61) PPARAPPARDPPARGPTPN1PSEN1
SCHEMBL3922 0.91 PPARA (0.61) PPARAPPARDPPARGPTPN1PSEN1
SCHEMBL29358494 0.91 PPARA (0.61) PPARAPPARDPPARGPTPN1PSEN1
SCHEMBL6236525 0.88 ROCK2 (0.49) PPARAPPARDPPARGLMNAROCK2
SCHEMBL13847879 0.87 PTPN1 (0.51) PPARAPPARGLMNAROCK2ROCK1
SCHEMBL13524847 0.87 PTPN1 (0.51) PPARAPPARGLMNAPTPN1
SCHEMBL6378335 0.86 FFAR1 (0.55) PPARAPPARGLMNASMN1; SMN2ROCK2
SCHEMBL6605626 0.85 PPARA (0.56) PPARAPPARDPPARGLMNASMN1; SMN2
SCHEMBL305177 0.84 PTPN1 (0.49) PPARAPPARDPPARGLMNASMN1; 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
EP-1207158-B1 SUBSTITUTED BENZYLTHIAZOLIDINE-2,4-DIONE DERIVATIVES KYORIN SEIYAKU KK (JP) 2005-05-25 EP claimed