SCHEMBL17051352

SCHEMBL17051352

C=CCOCC(O)COc1ccc(N(CC2CO2)CC2CO2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 2/20 0.41
▸ POLB P06746 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ CA1 P00915 3/20 0.36
▸ CA2 P00918 3/20 0.36
▸ CA7 P43166 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MAPT P10636 2/20 0.35
▸ CA4 P22748 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ LMNA P02545 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ ATM Q13315 1/20 0.32

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
SCHEMBL17345230 0.84 MEN1 (0.45) POLBSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL16640993 0.83 CA12 (0.40) CYP2D6POLBSMN1; SMN2ALDH1A1CA1
SCHEMBL17051349 0.81 ALDH1A1 (0.35) CYP2D6ALDH1A1CA1CA2CA7
SCHEMBL17051338 0.80 ALDH1A1 (0.42) CYP2D6POLBSMN1; SMN2ALDH1A1CA1
SCHEMBL17051347 0.80 ALDH1A1 (0.42) CYP2D6POLBSMN1; SMN2ALDH1A1CA1
SCHEMBL17051342 0.80 ALDH1A1 (0.42) CYP2D6POLBSMN1; SMN2ALDH1A1CA1
SCHEMBL21203079 0.80 MEN1 (0.42) POLBSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL17051375 0.77 ALDH1A1 (0.61) CYP2D6SMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL17366057 0.77 MEN1 (0.39) POLBSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL24933345 0.76 CYP2D6 (0.50) CYP2D6POLBSMN1; SMN2ALDH1A1CA1

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-9725590-B2 Epoxy compound having alkoxysilyl group, method for preparing the same, composition including the same, cured product made from the composition, and use of the composition KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2017-08-08 — — US disclosed
US-9725590-B2 Epoxy compound having alkoxysilyl group, method for preparing the same, composition including the same, cured product made from the composition, and use of the composition KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2017-08-08 — — US disclosed
US-20150247033-A1 EPOXY COMPOUND HAVING ALKOXYSILYL GROUP, METHOD FOR PREPARING THE SAME, COMPOSITION INCLUDING THE SAME, CURED PRODUCT MADE FROM THE COMPOSITION, AND USE OF THE COMPOSITION KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-09-03 — — US disclosed
US-20150247033-A1 EPOXY COMPOUND HAVING ALKOXYSILYL GROUP, METHOD FOR PREPARING THE SAME, COMPOSITION INCLUDING THE SAME, CURED PRODUCT MADE FROM THE COMPOSITION, AND USE OF THE COMPOSITION KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-09-03 — — 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-20150247033-A1 EPOXY COMPOUND HAVING ALKOXYSILYL GROUP, METHOD FOR PREPARING THE SAME, COMPOSITION INCLUDING THE SAME, CURED PRODUCT MADE FROM THE COMPOSITION, AND USE OF THE COMPOSITION ESD, ELL, ALOX5 CYP2D6 4228/4885POLB 1953/4885SMN1; SMN2 1640/4885

“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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