SCHEMBL8935730

SCHEMBL8935730

CCC(Oc1ccccc1C(C)(C)C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.54
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
GAA P10253 2/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
PPARA Q07869 4/20 0.43
RBP4 P02753 2/20 0.42
NAMPT P43490 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL8935731 1.00 PPARG (0.54) PPARGALDH1A1KDM4EGAARXRA
SCHEMBL5861902 0.86 PPARG (0.72) PPARGRXRARXRBRXRGATM
SCHEMBL28634308 0.83 SMN1; SMN2 (0.46) PPARGALDH1A1GAASMN1; SMN2PPARA
SCHEMBL28331362 0.81 SMN1; SMN2 (0.46) PPARGALDH1A1KDM4EGAARXRA
SCHEMBL133937 0.79 PPARG (0.46) PPARGALDH1A1KDM4EGAARXRA
SCHEMBL8935641 0.79 SMN1; SMN2 (0.57) PPARGALDH1A1KDM4ERXRARXRB
SCHEMBL8935961 0.79 SMN1; SMN2 (0.49) PPARGSMN1; SMN2NPSR1PPARATSHR
SCHEMBL17633012 0.79 SMN1; SMN2 (0.49) PPARGGAASMN1; SMN2PPARATSHR
SCHEMBL8935639 0.79 KMT2A (0.62) PPARGALDH1A1SMN1; SMN2NPSR1PPARA
SCHEMBL4650644 0.79 KMT2A (0.62) PPARGALDH1A1SMN1; SMN2NPSR1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed