SCHEMBL21705205

SCHEMBL21705205

C=C(C)C(=O)OCCCc1ccc(OCC2CO2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
TDP1 Q9NUW8 2/20 0.49
POLB P06746 1/20 0.49
APEX1 P27695 1/20 0.49
HTT P42858 1/20 0.49
MGLL Q99685 3/20 0.43
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 2/20 0.43
PKM P14618 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.43
PPARG P37231 1/20 0.43
HIF1A Q16665 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
NPC1 O15118 1/20 0.39
FFAR1 O14842 1/20 0.39

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
SCHEMBL21680104 0.93 ALDH1A1 (0.55) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL4399533 0.89 ALDH1A1 (0.59) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL26158413 0.88 ALDH1A1 (0.45) ALDH1A1TDP1MGLLTP53MAPT
SCHEMBL7605012 0.85 ALDH1A1 (0.55) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL4402111 0.85 ALDH1A1 (0.55) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL21680120 0.85 ALDH1A1 (0.57) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL21705211 0.82 ALDH1A1 (0.46) ALDH1A1POLBMEN1KMT2ANPC1
SCHEMBL18931416 0.82 POLB (0.48) TDP1POLBAPEX1HTTFFAR1
SCHEMBL7661052 0.81 ALDH1A1 (0.64) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL4401955 0.81 ALDH1A1 (0.64) ALDH1A1TDP1POLBAPEX1HTT

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-11667669-B2 Epoxy-(meth)acrylate monomers and polymers and methods of making and using the same ROWAN UNIVERSITY (US) 2023-06-06 US disclosed
US-20200048301-A1 EPOXY-(METH)ACRYLATE MONOMERS AND POLYMERS AND METHODS OF MAKING AND USING THE SAME ROWAN UNIVERSITY 2020-02-13 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-11667669-B2 Epoxy-(meth)acrylate monomers and polymers and methods of making and using the same PTGES, PTGIS, EPX ALDH1A1 102/4885TDP1 1671/4885POLB 1937/4885
US-20200048301-A1 EPOXY-(METH)ACRYLATE MONOMERS AND POLYMERS AND METHODS OF MAKING AND USING THE SAME PTGES, PTGIS, EPX ALDH1A1 102/4885TDP1 1671/4885POLB 1937/4885

“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.