SCHEMBL7142863

SCHEMBL7142863

COC(OC)C(O)CC(c1ccccc1)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 5/20 0.34
MEN1 O00255 3/20 0.34
RIPK1 Q13546 1/20 0.33
HTT P42858 1/20 0.32
POLB P06746 2/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
KCNN4 O15554 1/20 0.32
ACP3 P15309 1/20 0.31
SLC6A3 Q01959 1/20 0.31
TRPA1 O75762 2/20 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
SCHEMBL756292 0.70 LMNA (0.45) LMNAKMT2AMEN1RIPK1POLB
SCHEMBL11588095 0.69 LMNA (0.43) LMNAKMT2AMEN1RIPK1POLB
SCHEMBL11590303 0.69 LMNA (0.43) LMNAKMT2AMEN1RIPK1POLB
SCHEMBL10417502 0.68 KCNN4 (0.47) LMNAKMT2AKCNN4
SCHEMBL6738852 0.67 AOC3 (0.41) LMNAKMT2AMEN1RIPK1KCNN4
SCHEMBL7912705 0.67 MAPT (0.36) LMNAKMT2AKCNN4
SCHEMBL8403351 0.67 KDM4E (0.43) LMNAKMT2AACP3
SCHEMBL8587190 0.67 KDM4E (0.43) LMNAKMT2AACP3
SCHEMBL15233759 0.67 KMT2A (0.35) KMT2AHTTKCNN4
SCHEMBL934392 0.66 MAPK1 (0.38) THRBKMT2AKCNN4

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
US-20030065146-A1 Monomeric diols, phosphate linked oligomers formed therefrom and processes for preparing COOK PHILLIP D (US) 2003-04-03 US disclosed
US-6448373-B1 INHIBITORS OF ENZYMES SUCH AS PHOSPHOLIPASE A2; TREATMENT OF INFLAMMATORY DISEASES INCLUDING ATOPIC DERMATITIS AND INFLAMMATORY BOWEL DISEASE ISIS PHARMACEUTICALS, INC. 2002-09-10 US disclosed
EP-0739351-B1 MONOMERIC DIOLS AND PHOSPHATE LINKED OLIGOMERS FORMED THEREFROM ISIS PHARMACEUTICALS INC (US) 2002-04-10 EP disclosed
US-5886177-A ETHYLENE GLYCOL MONOMERS JOINED VIA STANDARD PHOSPHATE LINKAGES INCLUDING PHOSPHOROTHIOATE, PHOSPHODIESTER, AND PHOSPHORAMIDATE LINKAGES; USEFUL FUNCTIONAL GROUPS INCLUDE NUCLEOBASES AS WELL AS POLAR GROUPS, HYDROPHOBIC GROUPS ISIS PHARMACEUTICALS, INC. (US) 1999-03-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030065146-A1 Monomeric diols, phosphate linked oligomers formed therefrom and processes for preparing BPGM, PPIP5K2, PGM2 LMNA 2734/4885THRB 4419/4885KMT2A 4495/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.