SCHEMBL9008074

SCHEMBL9008074

Cc1oc(-c2ccccc2)nc1CCC(O[Si](C)(C)C(C)(C)C)c1ccc(CN2C(=O)CSC2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
POLB P06746 1/20 0.40
PPARG P37231 16/20 0.39
PPARA Q07869 11/20 0.39
PPARD Q03181 5/20 0.39
HRH3 Q9Y5N1 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL9008046 0.84 GSK3A (0.46) GSK3AGSK3BPPARGPPARAPPARD
SCHEMBL9008047 0.78 GSK3A (0.46) GSK3AGSK3BPPARGPPARAPPARD
SCHEMBL7879102 0.78 PPARG (0.46) PPARGPPARAPPARDHRH3
SCHEMBL7879105 0.78 PPARG (0.46) PPARGPPARAPPARDHRH3
SCHEMBL8650155 0.77 FFAR1 (0.57) GSK3AGSK3BPPARGPPARA
SCHEMBL9521721 0.72 PPARG (0.44) PPARGPPARAPPARDHRH3
SCHEMBL9008053 0.71 PPARA (0.47) PPARGPPARAPPARDHRH3
SCHEMBL9520686 0.71 PPARG (0.44) PPARGPPARAPPARDHRH3
SCHEMBL10365325 0.70 FFAR1 (0.56) PPARGPPARAPPARD
SCHEMBL9521124 0.69 PPARG (0.38) GSK3BPPARGPPARAPPARDHRH3

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
US-5512689-A TREATING A STARTING KETONE WITH A BORANE REDUCING AGENT IN THE PRESENCE OF A CHIRAL OXAZABOROLIDINE CATLAYST, PRODUCT FREE OF ENANTIMERS PFIZER INC. (US) 1996-04-30 US disclosed