SCHEMBL8059986

SCHEMBL8059986

CCC(=O)c1cc(F)cc(F)c1OC(Br)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.41
PPARG P37231 4/20 0.39
SLC6A4 P31645 1/20 0.34
LMNA P02545 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ABCB1 P08183 1/20 0.33
CTSA P10619 2/20 0.33
HTT P42858 2/20 0.32
ALOX15 P16050 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL6811644 0.83 PPARA (0.52) PPARAPPARGLMNAALDH1A1HPGD
SCHEMBL21059484 0.78 TDP1 (0.36) PPARAPPARGTSHRKMT2A
SCHEMBL21059487 0.78 TDP1 (0.36) PPARAPPARGTSHRKMT2A
SCHEMBL6811455 0.74 PPARA (0.71) PPARAPPARGSLC6A4ALDH1A1SMN1; SMN2
SCHEMBL8057944 0.72 PPARA (0.45) PPARAPPARGSLC6A4LMNAALDH1A1
SCHEMBL586226 0.69 SMN1; SMN2 (0.51) PPARAPPARGLMNAALDH1A1HPGD
SCHEMBL28673209 0.68 BMP1 (0.35) PPARAPPARGALDH1A1HPGDKDM4E
SCHEMBL28673207 0.68 BMP1 (0.35) PPARAPPARGALDH1A1HPGDKDM4E
SCHEMBL6744505 0.67 CES2 (0.42) ALDH1A1HPGDHTTSMN1; SMN2RXFP1
SCHEMBL5883770 0.66 CES2 (0.61) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A

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-6046213-A Neuroprotective 3-(piperidinyl-1)-chroman-4,7-diol and 1-(4-hydroxyphenyl)-2-(piperidinyl-1)-alkanol derivatives PFIZER INC. (US) 2000-04-04 US disclosed