SCHEMBL9520935

SCHEMBL9520935

Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CCC(O)c1ccc(C=C2SC(=O)NC2=O)s1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.42
PPARA Q07869 7/20 0.41
PIM2 Q9P1W9 1/20 0.41
NR1H4 Q96RI1 1/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PPARG P37231 6/20 0.37
PTPN1 P18031 1/20 0.37
CTSS P25774 1/20 0.36
RXRA P19793 1/20 0.35

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
SCHEMBL9520931 1.00 PIM1 (0.42) PIM1PPARAPIM2NR1H4KDM4E
SCHEMBL9721298 0.89 NPC1 (0.41) PPARAKDM4EPPARG
SCHEMBL9721300 0.89 NPC1 (0.41) PPARAKDM4EPPARG
SCHEMBL9520852 0.83 PPARA (0.44) PIM1PPARAPIM2NR1H4KDM4E
SCHEMBL9520845 0.83 PPARA (0.44) PIM1PPARAPIM2NR1H4KDM4E
SCHEMBL9521653 0.78 PIM1 (0.50) PIM1PPARAPIM2NR1H4PPARG
SCHEMBL9521656 0.78 PIM1 (0.50) PIM1PPARAPIM2NR1H4PPARG
SCHEMBL9521119 0.77 PPARG (0.38) PPARAPPARG
SCHEMBL9521124 0.77 PPARG (0.38) PPARAPPARG
SCHEMBL9879230 0.74 PIK3CG (0.40) PIM1PPARAPIM2NR1H4

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