SCHEMBL9526288

SCHEMBL9526288

C[S+]([O-])c1nc(-c2ccccc2)c(-c2ccccc2)n1COCC[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F11 P03951 1/20 0.36
NPC1 O15118 1/20 0.33
FAAH O00519 8/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
DGAT1 O75907 1/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
USP2 O75604 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL9525306 0.82 F11 (0.34) F11FAAHCNR1CNR2PLA2G4A
SCHEMBL9525207 0.78 MAPK14 (0.43) F11NPC1KDM4EALDH1A1L3MBTL1
SCHEMBL4069849 0.77 F11 (0.39) F11NPC1FAAHKDM4EALDH1A1
SCHEMBL9540401 0.76 SOAT1 (0.41) FAAHALDH1A1SMN1; SMN2CYP3A4CYP2D6
SCHEMBL9737058 0.74 F11 (0.37) F11NPC1FAAHKDM4EALDH1A1
SCHEMBL9737053 0.74 F11 (0.37) F11NPC1FAAHKDM4EALDH1A1
SCHEMBL9736572 0.74 F11 (0.37) F11NPC1FAAHKDM4EALDH1A1
SCHEMBL2846531 0.74 FAAH (0.43) F11NPC1FAAHKDM4EMEN1
SCHEMBL9736574 0.74 F11 (0.37) F11NPC1FAAHKDM4EALDH1A1
SCHEMBL9370452 0.73 FAAH (0.41) F11NPC1FAAHKDM4EALDH1A1

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
WO-1993001183-A1 IMIDAZOLE DERIVATIVE AS ACAT INHIBITOR RHONE-POULENC RORER LIMITED (GB) 1993-01-21 WO disclosed
WO-1993001184-A1 IMIDAZOLES INHIBITORS AS ACAT AND THROMBOXANE TXA2 RHONE-POULENC RORER LIMITED (GB) 1993-01-21 WO disclosed
EP-0523941-A1 Imidazoles as ACAT inhibitor RHONE-POULENC RORER LIMITED (GB) 1993-01-20 EP disclosed
EP-0522887-A1 Imidazoles as ACAT- and thromboxane TxA2 inhibitors RHONE-POULENC RORER LIMITED (GB) 1993-01-13 EP disclosed