SCHEMBL9521653

SCHEMBL9521653

Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CCC(=O)c1ccc(/C=C2/SC(=O)NC2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.50
PIM2 Q9P1W9 2/20 0.50
PPARA Q07869 4/20 0.46
PTPN1 P18031 6/20 0.44
PPARG P37231 3/20 0.43
TTR P02766 1/20 0.41
CISD1 Q9NZ45 1/20 0.41
FOXM1 Q08050 1/20 0.40
HDAC4 P56524 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
ESRRA P11474 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
SCHEMBL9521656 1.00 PIM1 (0.50) PIM1PIM2PPARAPTPN1PPARG
SCHEMBL9521141 0.90 PIM1 (0.49) PIM1PIM2PPARAPTPN1PPARG
SCHEMBL9521137 0.90 PIM1 (0.49) PIM1PIM2PPARAPTPN1PPARG
SCHEMBL9520104 0.88 KDM4E (0.45) PIM1PIM2PPARAPPARG
SCHEMBL9520097 0.88 KDM4E (0.45) PIM1PIM2PPARAPPARG
SCHEMBL9520845 0.87 PPARA (0.44) PIM1PIM2PPARAPTPN1PPARG
SCHEMBL9520852 0.87 PPARA (0.44) PIM1PIM2PPARAPTPN1PPARG
SCHEMBL9521885 0.84 PTPN1 (0.43) PIM1PPARAPTPN1PPARGHDAC4
SCHEMBL9521889 0.84 PTPN1 (0.43) PIM1PPARAPTPN1PPARGHDAC4
SCHEMBL10589881 0.84 PPARA (0.44) PPARAPTPN1PPARG

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-1991003474-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1991-03-21 WO disclosed