SCHEMBL6219628

SCHEMBL6219628

CN(C)C(=O)Sc1c[c]ccc1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 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
SCHEMBL6972687 0.79 CA12 (0.36) ALDH1A1
SCHEMBL19118530 0.77 ALDH1A1 (0.42) ALDH1A1RAB9A
SCHEMBL7405360 0.77 FFAR1 (0.33) ALDH1A1
SCHEMBL7776861 0.77 ALDH1A1 (0.45) ALDH1A1RAB9A
SCHEMBL2571596 0.75 LMNA (0.33)
SCHEMBL28938346 0.74 FFAR1 (0.31)
SCHEMBL20244667 0.74 ALDH1A1 (0.53) ALDH1A1RAB9A
SCHEMBL23581639 0.74 CYP3A4 (0.30)
SCHEMBL6969403 0.71 TTR (0.40) ALDH1A1RAB9A
SCHEMBL22852718 0.69 TERT (0.47) ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585726-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-10-19 EP disclosed
WO-2004063155-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed