SCHEMBL9520845

SCHEMBL9520845

Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CCC(=O)c1ccc(/C=C2/SC(=O)NC2=O)s1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.44
PIM1 P11309 3/20 0.42
PIM2 Q9P1W9 1/20 0.42
PPARG P37231 4/20 0.41
NR1H4 Q96RI1 1/20 0.40
PTPN1 P18031 3/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CTSS P25774 1/20 0.37
HDAC4 P56524 1/20 0.37
RXRA P19793 1/20 0.36

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
SCHEMBL9520852 1.00 PPARA (0.44) PPARAPIM1PIM2PPARGNR1H4
SCHEMBL9521653 0.87 PIM1 (0.50) PPARAPIM1PIM2PPARGNR1H4
SCHEMBL9521656 0.87 PIM1 (0.50) PPARAPIM1PIM2PPARGNR1H4
SCHEMBL9520935 0.83 PIM1 (0.42) PPARAPIM1PIM2PPARGNR1H4
SCHEMBL9520931 0.83 PIM1 (0.42) PPARAPIM1PIM2PPARGNR1H4
SCHEMBL9521137 0.77 PIM1 (0.49) PPARAPIM1PIM2PPARGPTPN1
SCHEMBL9521141 0.77 PIM1 (0.49) PPARAPIM1PIM2PPARGPTPN1
SCHEMBL9520097 0.75 KDM4E (0.45) PPARAPIM1PIM2PPARGKDM4E
SCHEMBL9520104 0.75 KDM4E (0.45) PPARAPIM1PIM2PPARGKDM4E
SCHEMBL10589881 0.73 PPARA (0.44) PPARAPPARGPTPN1KDM4EL3MBTL1

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
EP-0332332-A1 Hypoglycemic thiazolidinedione derivatives PFIZER INC. (US) 1989-09-13 EP disclosed