SCHEMBL5990230

SCHEMBL5990230

CCc1ccc(OC)c(C(=O)c2ccccc2C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.46
LMNA P02545 3/20 0.45
ATM Q13315 2/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PDE7A Q13946 1/20 0.43
PDE3A Q14432 1/20 0.43
HPGD P15428 1/20 0.43
S1PR1 P21453 1/20 0.43
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
PPARA Q07869 4/20 0.41
PPARD Q03181 2/20 0.41

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
SCHEMBL5990096 0.83 LMNA (0.42) LMNAGAASMN1; SMN2KCNK3KCNK9
SCHEMBL5991233 0.78 PPARG (0.56) LMNAATMMAPTSMN1; SMN2NPSR1
SCHEMBL30785075 0.78 PPARG (0.56) LMNAATMMAPTSMN1; SMN2NPSR1
SCHEMBL5989871 0.78 CDC25B (0.56)
SCHEMBL5989236 0.78 PPARA (0.52) MAPTNPSR1PPARAPPARDPPARG
SCHEMBL5989823 0.78 PPARA (0.52) MAOBLMNAMAPTSMN1; SMN2HSD17B10
SCHEMBL5991276 0.76 CTNNB1 (0.51) LMNAGAAMAPTSMN1; SMN2NPC1
SCHEMBL18650496 0.75 KCNK3 (0.36) LMNAGAASMN1; SMN2KCNK3KCNK9
SCHEMBL9726523 0.75 NPC1 (0.56) LMNAATMGAAMAPTSMN1; SMN2
SCHEMBL12013165 0.74 S1PR1 (0.46) GAAS1PR1PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 WO disclosed