SCHEMBL6942222

SCHEMBL6942222

CCOP(=O)(OCC)C(=Cc1cc(C(C)(C)C)c(O)c2ccccc12)P(=O)(O)OC(C)CC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 5/20 0.48
NR1I2 O75469 3/20 0.48
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 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
SCHEMBL6942208 0.87 HMGCR (0.63) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL7080094 0.78 HMGCR (0.51) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL7083575 0.78 HMGCR (0.63) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL7083231 0.77 HMGCR (0.49) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL9358182 0.75 MEN1 (0.40) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL7759881 0.70 NR1I2 (0.54) HMGCRNR1I2MEN1KMT2A
SCHEMBL7760639 0.69 NR1I2 (0.53) HMGCRNR1I2MEN1KMT2ACYP3A4
SCHEMBL7137096 0.67 HMGCR (0.83) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL678403 0.67 HMGCR (1.00) HMGCRNR1I2MEN1GAAKMT2A
SCHEMBL7080881 0.66 HMGCR (0.62) HMGCRNR1I2MEN1KMT2ACYP1A2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003513909-A 2003-04-15 JP claimed
EP-1229907-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-08-14 EP claimed
WO-2001034127-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-05-17 WO claimed
EP-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP claimed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO claimed
EP-1229907-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-08-14 EP disclosed
WO-2001034127-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-05-17 WO disclosed
EP-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP disclosed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO disclosed