SCHEMBL6914237

SCHEMBL6914237

CCOP(=O)(CC)OCC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.48
NR1I2 O75469 1/20 0.48
LMNA P02545 1/20 0.48
RECQL P46063 1/20 0.48
ALOX5 P09917 2/20 0.46
PTGS1 P23219 2/20 0.46
PTGS2 P35354 2/20 0.46
TSHR P16473 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
F2R P25116 6/20 0.39
GPR55 Q9Y2T6 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6916388 0.80 HMGCR (0.44) HMGCRNR1I2LMNARECQLALOX5
SCHEMBL6909440 0.80 HMGCR (0.50) HMGCRNR1I2LMNARECQLTSHR
SCHEMBL6917885 0.80 HMGCR (0.53) HMGCRNR1I2LMNARECQLALOX5
SCHEMBL1305322 0.79 HMGCR (0.58) HMGCRNR1I2LMNARECQLTSHR
SCHEMBL6919061 0.79 HMGCR (0.43) HMGCRNR1I2LMNARECQLTSHR
SCHEMBL9222900 0.79 HMGCR (0.46) HMGCRNR1I2LMNARECQLALOX5
SCHEMBL6914648 0.79 HMGCR (0.43) HMGCRNR1I2LMNARECQLTSHR
SCHEMBL2484689 0.78 LMNA (0.53) HMGCRNR1I2LMNARECQLALOX5
SCHEMBL6916387 0.78 LMNA (0.47) HMGCRNR1I2LMNARECQLALOX5
SCHEMBL6919076 0.78 HMGCR (0.57) HMGCRNR1I2LMNARECQLPTGS1

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
WO-2004026245-A2 SUBSTITUTED PHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY ILEX ONCOLOGY RESEARCH, SARL (CH) 2004-04-01 WO claimed