SCHEMBL19632601

SCHEMBL19632601

CCCCOc1c(OC)cc(C(O)C(CO)Oc2ccccc2OC)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 1/20 0.43
MMP9 P14780 1/20 0.42
LMNA P02545 3/20 0.41
AGTR1 P30556 1/20 0.41
CYP1A2 P05177 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40
PPARD Q03181 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 3/20 0.37
PDE4B Q07343 1/20 0.37
HPGD P15428 1/20 0.37
TP53 P04637 2/20 0.36
TSHR P16473 2/20 0.36
ALOX15 P16050 1/20 0.36
ATM Q13315 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
SCHEMBL17997738 0.87 PPARG (0.51) MMP9LMNAAGTR1CYP1A2PPARG
SCHEMBL15966172 0.87 PPARG (0.51) MMP9LMNAAGTR1CYP1A2PPARG
SCHEMBL15954804 0.86 MMP9 (0.50) MMP9LMNAAGTR1CYP1A2SMN1; SMN2
SCHEMBL19632845 0.83 MGAM (0.42) MMP9LMNAAGTR1CYP1A2PPARG
SCHEMBL15965417 0.81 MMP9 (0.47) MMP9LMNAAGTR1CYP1A2SMN1; SMN2
SCHEMBL13499773 0.81 MMP9 (0.50) MMP9LMNAAGTR1CYP1A2PPARG
SCHEMBL9579548 0.79 PPARG (0.63) MMP9LMNAAGTR1CYP1A2SMN1; SMN2
SCHEMBL29940872 0.79 PPARG (0.63) MMP9LMNAAGTR1CYP1A2SMN1; SMN2
SCHEMBL22833918 0.79 PPARG (0.63) MMP9LMNAAGTR1CYP1A2SMN1; SMN2
SCHEMBL17997741 0.78 PPARG (0.55) MMP9LMNAAGTR1CYP1A2SMN1; SMN2

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
US-20170334819-A1 A MILD CATALYTIC REDUCTION OF C-O BONDS AND C=O BONDS USING A RECYCLABLE CATALYST SYSTEM ORGANOFUEL SWEDEN AB (SE) 2017-11-23 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-20170334819-A1 A MILD CATALYTIC REDUCTION OF C-O BONDS AND C=O BONDS USING A RECYCLABLE CATALYST SYSTEM CBR1, ADH1C, AOC2 SLC6A5 3670/4885MMP9 3336/4885LMNA 1038/4885

“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.