SCHEMBL8080772

SCHEMBL8080772

CCCCCCCCCCCCSCC(=O)NNCC(=O)Nc1cc(C)c(O)c(C)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.50
ACAT1 P24752 1/20 0.50
SOAT1 P35610 1/20 0.50
MAPT P10636 3/20 0.36
CES2 O00748 3/20 0.36
THRB P10828 2/20 0.36
GMNN O75496 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HPGD P15428 3/20 0.36
ALDH1A1 P00352 3/20 0.36
GLA P06280 1/20 0.36
PLK1 P53350 3/20 0.34
FAAH O00519 4/20 0.33
CES1 P23141 4/20 0.33
PLA2G6 O60733 1/20 0.33
ESR1 P03372 1/20 0.33

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
SCHEMBL8045136 0.90 SOAT2 (0.56) SOAT2ACAT1SOAT1MAPTCES2
SCHEMBL8080878 0.82 SOAT2 (0.48) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL8080763 0.82 SOAT2 (0.57) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL8079964 0.81 SOAT2 (0.56) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL8043376 0.80 SOAT2 (0.60) SOAT2ACAT1SOAT1MAPTCES2
SCHEMBL8072066 0.78 ACAT1 (0.43) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL8079670 0.78 SOAT1 (0.79) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL9446351 0.76 SOAT1 (0.53) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL9446297 0.76 SOAT1 (0.53) SOAT2ACAT1SOAT1MAPTTHRB
SCHEMBL9446369 0.76 SOAT1 (0.53) SOAT2ACAT1SOAT1MAPTTHRB

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-0871611-B1 NEW DERIVATIVES OF GLYCYLANILIDES, PREPARATION AND THERAPEUTICAL APPLICATION PF MEDICAMENT (FR) 2000-09-13 EP claimed
US-5760087-A ANTICHOLESTEROL AGENTS PIERRE FABRE MEDICAMENT (FR) 1998-06-02 US claimed
EP-0871611-B1 NEW DERIVATIVES OF GLYCYLANILIDES, PREPARATION AND THERAPEUTICAL APPLICATION PF MEDICAMENT (FR) 2000-09-13 EP disclosed
US-5760087-A ANTICHOLESTEROL AGENTS PIERRE FABRE MEDICAMENT (FR) 1998-06-02 US disclosed