SCHEMBL3250259

SCHEMBL3250259

CC(C)(C)c1cc(O)c(C(C)(C)C)cc1O.CCCCCCCCCCCCCCCCCCOC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
KMT2A Q03164 1/20 0.49
ESR1 P03372 2/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
DGKA P23743 1/20 0.43
CNR2 P34972 2/20 0.43
CNR1 P21554 1/20 0.41

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
SCHEMBL284382 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL283853 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL754404 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL284357 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
Octane SCHEMBL21828749 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL17491243 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL13899816 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL2050437 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL208070 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3
SCHEMBL283875 0.95 GAA (0.53) GAAKMT2AESR1AKR1C4AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1844761-B1 Cosmetic or pharmaceutical composition comprising a condensation polymer, cosmetic treatment method employing said composition, said condensation polymer and preparation method OREAL (FR) 2010-05-19 EP claimed
US-20080069786-A1 POLYCONDENSATE, COMPOSITION, TREATMENT PROCESS, AND PREPARATION PROCESS L'OREAL (FR) 2008-03-20 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-20080069786-A1 POLYCONDENSATE, COMPOSITION, TREATMENT PROCESS, AND PREPARATION PROCESS POLR1C, PIK3C3, SUV39H2 GAA 1891/4885KMT2A 74/4885ESR1 4021/4885

“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.