SCHEMBL15258917

SCHEMBL15258917

COCC(O)COc1ccc(C(C)c2ccc(OCC(O)COc3ccc(C(C)(C)c4ccc(OCC(O)COC)cc4)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.56
▸ HIF1A Q16665 1/20 0.56
▸ AR P10275 1/20 0.55
▸ KMT2A Q03164 3/20 0.47
▸ MAPT P10636 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ NR3C1 P04150 1/20 0.42
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ CYP2J2 P51589 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ LMNA P02545 3/20 0.42
▸ POLB P06746 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL12267323 0.91 HTT (0.65) HTTHIF1AARKMT2AMAPT
SCHEMBL10962758 0.91 HTT (0.65) HTTHIF1AARKMT2AMAPT
SCHEMBL12267196 0.87 HTT (0.57) HTTHIF1AARKMT2AMAPT
SCHEMBL12267326 0.86 HTT (0.59) HTTHIF1AARKMT2AMAPT
SCHEMBL12135524 0.85 HTT (0.58) HTTHIF1AARKMT2AMAPT
SCHEMBL13963728 0.85 HTT (0.58) HTTHIF1AARKMT2AMAPT
SCHEMBL13513166 0.85 AR (0.74) HTTHIF1AARKMT2AMAPT
SCHEMBL12267193 0.85 HTT (0.58) HTTHIF1AARKMT2AMAPT
SCHEMBL12726584 0.85 HTT (0.58) HTTHIF1AARKMT2AMAPT
SCHEMBL16227106 0.84 AR (0.76) HTTHIF1AARKMT2AMAPT

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
US-20170121261-A1 DIGLYCIDIC ETHER DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE THE UNITED STATES GOVERNMENT 2017-05-04 — — US disclosed
US-20130245129-A1 DIGLYCIDIC ETHER DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-09-19 — — 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 (2 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-20170121261-A1 DIGLYCIDIC ETHER DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE UGCG, PTGFR, KLK3 HTT 4813/4885HIF1A 530/4885AR 206/4885
US-20130245129-A1 DIGLYCIDIC ETHER DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE MAN2B2, UGCG, KLK3 HTT 4659/4885HIF1A 1235/4885AR 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.

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