SCHEMBL9521119

SCHEMBL9521119

Cc1oc(-c2ccccc2)nc1CCC(O[Si](C)(C)C(C)(C)C)c1ccc(/C=C2/SC(=O)NC2=O)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.38
PPARA Q07869 9/20 0.38
PPARD Q03181 2/20 0.38
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 3/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
GALR3 O60755 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
STAT3 P40763 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PIK3CG P48736 1/20 0.35
PRF1 P14222 1/20 0.34
CCR2 P41597 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GSK3B P49841 1/20 0.34

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
SCHEMBL9521124 1.00 PPARG (0.38) PPARGPPARAPPARDKCNH2HRH3
SCHEMBL9721300 0.85 NPC1 (0.41) PPARGPPARAKCNH2HRH3MEN1
SCHEMBL9721298 0.85 NPC1 (0.41) PPARGPPARAKCNH2HRH3MEN1
SCHEMBL9521721 0.84 PPARG (0.44) PPARGPPARAPPARDHRH3
Benzene SCHEMBL9787641 0.84 PIM1 (0.35) PRF1
SCHEMBL9520686 0.78 PPARG (0.44) PPARGPPARAPPARDHRH3
SCHEMBL7879355 0.78 PIM1 (0.42) PPARGPPARAKCNH2HRH3MEN1
SCHEMBL7879358 0.78 PIM1 (0.42) PPARGPPARAKCNH2HRH3MEN1
SCHEMBL7879353 0.78 PIM1 (0.42) PPARGPPARAKCNH2HRH3MEN1
SCHEMBL9721263 0.78 MAPT (0.36) PPARGPPARAPPARDMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332332-B1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1993-03-31 EP disclosed
US-5130379-A Anticholesterol agents and antidiabetic agents PFIZER INC. (US) 1992-07-14 US disclosed
US-5036079-A Anticholesterol PFIZER INC. (US) 1991-07-30 US disclosed
WO-1989008651-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1989-09-21 WO disclosed