SCHEMBL8043291

SCHEMBL8043291

CCCCCCCCCCCCSC(C(=O)Nc1cc(C)c(O)c(C)c1C)C(C)C.CCCCCCCCCCCCSC(CCCC)C(=O)Nc1cc(C)c(O)c(C)c1C

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.59
ACAT1 P24752 1/20 0.59
SOAT1 P35610 1/20 0.59
LMNA P02545 1/20 0.32
EPHX1 P07099 1/20 0.32
ESR1 P03372 1/20 0.31
HSD17B10 Q99714 1/20 0.30
PLK1 P53350 3/20 0.30
PTGES O14684 2/20 0.30
ALOX5 P09917 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL8416104 0.93 SOAT2 (0.67) SOAT2ACAT1SOAT1LMNAEPHX1
SCHEMBL8049344 0.93 SOAT2 (0.67) SOAT2ACAT1SOAT1LMNAEPHX1
SCHEMBL8042246 0.88 SOAT2 (0.67) SOAT2ACAT1SOAT1LMNAEPHX1
SCHEMBL8049436 0.85 SOAT2 (0.68) SOAT2ACAT1SOAT1LMNAEPHX1
SCHEMBL8043445 0.82 SOAT2 (0.69) SOAT2ACAT1SOAT1LMNAEPHX1
SCHEMBL24482943 0.76 SOAT2 (0.62) SOAT2ACAT1SOAT1LMNAEPHX1
SCHEMBL8086038 0.76 SOAT2 (0.59) SOAT2ACAT1SOAT1ESR1PLK1
SCHEMBL9446304 0.76 SOAT2 (0.57) SOAT2ACAT1SOAT1LMNAESR1
SCHEMBL9446292 0.76 SOAT2 (0.57) SOAT2ACAT1SOAT1LMNAESR1
SCHEMBL8043376 0.75 SOAT2 (0.60) SOAT2ACAT1SOAT1EPHX1ESR1

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
EP-0874812-B1 NOVEL 2,3,5-TRIMETHYL-4-HYDROXY ANILIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USE THEREOF PF MEDICAMENT (FR) 2000-04-05 EP claimed