SCHEMBL12220623

SCHEMBL12220623

O=C1CCOC(c2ccc(O)c(O)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
POLB P06746 3/20 0.48
ALPI P09923 3/20 0.48
GAA P10253 3/20 0.48
MAPT P10636 3/20 0.48
RECQL P46063 2/20 0.48
BLM P54132 1/20 0.48
MCL1 Q07820 1/20 0.48
ATM Q13315 1/20 0.48
YWHAG P61981 1/20 0.48
CYP19A1 P11511 3/20 0.46
ALPL P05186 2/20 0.46
ALPG P10696 2/20 0.46
PKM P14618 2/20 0.46
CA12 O43570 1/20 0.46
SLCO2B1 O94956 1/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
CA4 P22748 1/20 0.46
PSMB5 P28074 1/20 0.46

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
SCHEMBL12220617 0.81 ESR2 (0.50) POLBMAPTRECQLMCL1CYP19A1
SCHEMBL18366392 0.77 HTR2A (0.34)
SCHEMBL30587569 0.77 HTR2A (0.34)
SCHEMBL18366390 0.75 MAOB (0.43)
SCHEMBL20719804 0.75 CYP2C9 (0.38) GAACYP2C19HSD17B10MEN1KMT2A
SCHEMBL12673930 0.74 POLB (0.58) KDM4EPOLBALPIGAAMAPT
SCHEMBL8519316 0.74 TSHR (0.48) KDM4EGAAMAPTCYP19A1CYP1A1
SCHEMBL8676416 0.74 TSHR (0.48) KDM4EGAAMAPTCYP19A1CYP1A1
SCHEMBL4298893 0.74 TSHR (0.48) KDM4EGAAMAPTCYP19A1CYP1A1
SCHEMBL4296907 0.73 ALOX5 (0.62) KDM4EPOLBALPIGAAMAPT

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-20110256115-A1 HYDROSOLUBLE [6)O-ALPHA-D-GLCP-(1->]N-6-O-BETA-D-GLCP-(1->-PHENOLIC DERIVATIVES WITH DERMOCOSMETIC, NUTRITIONAL AND THERAPEUTIC APPLICATIONS, AND COMPOSITIONS CONTAINING SAID WATER SOLUBLE COMPOUNDS LIBRAGEN (FR) 2011-10-20 US disclosed
US-20110256115-A1 HYDROSOLUBLE [6)O-ALPHA-D-GLCP-(1->]N-6-O-BETA-D-GLCP-(1->-PHENOLIC DERIVATIVES WITH DERMOCOSMETIC, NUTRITIONAL AND THERAPEUTIC APPLICATIONS, AND COMPOSITIONS CONTAINING SAID WATER SOLUBLE COMPOUNDS LIBRAGEN (FR) 2011-10-20 US disclosed
WO-2010072754-A1 HYDROSOLUBLE [6)O-α-D-GLCP-(1→]n-6-O-β-D-GLCP-(1→-PHENOLIC DERIVATIVES WITH DERMOCOSMETIC, NUTRITIONAL AND THERAPEUTIC APPLICATIONS, AND COMPOSITIONS CONTAINING SAID WATER SOLUBLE COMPOUNDS LIBRAGEN (FR) 2010-07-01 WO disclosed
EP-2202237-A1 Hydrosoluble [6)-O-alpha-d-glcp-(1->]n-6-o-bêta-d-glcp-(1->-phenllic derivatives with dermocosmetic, nutritional and therapeutic applications, and compositions containing said water soluble compounds Libragen (FR) 2010-06-30 EP 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-20110256115-A1 HYDROSOLUBLE [6)O-ALPHA-D-GLCP-(1->]N-6-O-BETA-D-GLCP-(1->-PHENOLIC DERIVATIVES WITH DERMOCOSMETIC, NUTRITIONAL AND THERAPEUTIC APPLICATIONS, AND COMPOSITIONS CONTAINING SAID WATER SOLUBLE COMPOUNDS UGGT1, UGDH, CYP24A1 KDM4E 4249/4885POLB 536/4885ALPI 179/4885

“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.