SCHEMBL7065175

SCHEMBL7065175

CCOP(=O)(CC)OC(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 5/20 0.54
GAA P10253 6/20 0.43
KMT2A Q03164 4/20 0.43
NR1I2 O75469 1/20 0.40
MEN1 O00255 3/20 0.37
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
AGTR1 P30556 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RECQL P46063 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL9226227 0.80 HMGCR (0.49) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL6909440 0.78 HMGCR (0.50) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL27571607 0.76 HMGCR (0.56) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL9222249 0.76 GAA (0.47) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL27570668 0.74 HMGCR (0.59) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL1305322 0.73 HMGCR (0.58) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL27909258 0.72 HMGCR (0.60) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL39364 0.71 HMGCR (0.62) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL1704691 0.71 HMGCR (1.00) HMGCRGAAKMT2ANR1I2MEN1
SCHEMBL564169 0.70 HMGCR (0.61) HMGCRGAAKMT2ANR1I2MEN1

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 3 patents. 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 disclosed
EP-0638084-A1 SUBSTITUTED PHOSPHONATES, THE PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYMPHAR S.A. (CH) 1995-02-15 EP disclosed
WO-1994019358-A1 SUBSTITUTED PHOSPHONATES, THE PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYMPHAR S.A. (CH) 1994-09-01 WO disclosed