SCHEMBL8428449

SCHEMBL8428449

COCCCOc1ccc(CCCCCCCC(=O)O)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.54
CNR2 P34972 2/20 0.54
TSHR P16473 1/20 0.52
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LTB4R Q15722 3/20 0.47
FFAR1 O14842 2/20 0.47
DHFR P00374 1/20 0.47
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.44

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
SCHEMBL8432044 1.00 CNR1 (0.54) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL8428045 0.89 CNR2 (0.57) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL8714213 0.87 POLB (0.56) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL10767355 0.87 POLB (0.56) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL8430362 0.86 CNR1 (0.51) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL4419943 0.85 POLB (0.57) CNR1CNR2TSHRMEN1KMT2A
SCHEMBL2046234 0.83 PPARA (0.52) CNR1CNR2FFAR1DHFRPPARG
SCHEMBL8429999 0.83 CNR1 (0.51) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL8432156 0.83 CNR1 (0.53) CNR1CNR2TSHRALDH1A1MEN1
SCHEMBL27788117 0.82 POLB (0.60) CNR1CNR2TSHRMEN1KMT2A

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-5880147-A Amide derivatives having ACAT inhibitory activity, their preparation and their therapeutic and prohylactic use SANKYO COMPANY, LIMITED (JP) 1999-03-09 US disclosed