SCHEMBL3389253

SCHEMBL3389253

OCC(O)N(C(O)CO)C(O)CO

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.35
THRB P10828 1/20 0.32
TSHR P16473 1/20 0.31
OR51E2 Q9H255 1/20 0.30
AKR1B1 P15121 1/20 0.30

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
SCHEMBL9930368 0.72 LMNA (0.38) LMNAALDH1A1TDP1L3MBTL1THRB
SCHEMBL1258047 0.69
SCHEMBL16845318 0.69
SCHEMBL7713165 0.69 TDP1 (0.41) LMNAALDH1A1TDP1L3MBTL1TSHR
SCHEMBL37604 0.64 TSHR (0.44) TSHR
SCHEMBL87714 0.61
Glycerin SCHEMBL5610362 0.58 LMNA (1.00) LMNAALDH1A1TDP1L3MBTL1THRB
Ammonia Solution, Strong SCHEMBL20897527 0.58
E968 SCHEMBL17062 0.58
E968 SCHEMBL2723809 0.58 LMNA (0.67) LMNAALDH1A1TDP1L3MBTL1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114630888-A Method for reducing malodor on fabrics 宝洁公司 2022-06-14 CN claimed
US-8372435-B2 Modular monolayer coatings for selective attachment of nanoparticles to biomolecules PRINCETON UNIVERSITY (US) 2013-02-12 US claimed
US-20100034742-A1 MODULAR MONOLAYER COATINGS FOR SELECTIVE ATTACHMENT OF NANOPARTICLES TO BIOMOLECULES PRINCETON UNIVERSITY (US) 2010-02-11 US claimed
WO-2010008826-A1 MODULAR MONOLAYER COATINGS FOR SELECTIVE ATTACHMENT OF NANOPARTICLES TO BIOMOLECULES PRINCETON UNIVERSITY (US) 2010-01-21 WO claimed
CN-114630888-A Method for reducing malodor on fabrics 宝洁公司 2022-06-14 CN disclosed
CN-109517101-B Acrylate compound, photocurable composition containing same, photocurable cured film, and image display device 东友精细化工有限公司 2021-04-23 CN disclosed
US-8372435-B2 Modular monolayer coatings for selective attachment of nanoparticles to biomolecules PRINCETON UNIVERSITY (US) 2013-02-12 US disclosed
US-20100034742-A1 MODULAR MONOLAYER COATINGS FOR SELECTIVE ATTACHMENT OF NANOPARTICLES TO BIOMOLECULES PRINCETON UNIVERSITY (US) 2010-02-11 US disclosed
WO-2010008826-A1 MODULAR MONOLAYER COATINGS FOR SELECTIVE ATTACHMENT OF NANOPARTICLES TO BIOMOLECULES PRINCETON UNIVERSITY (US) 2010-01-21 WO 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-20100034742-A1 MODULAR MONOLAYER COATINGS FOR SELECTIVE ATTACHMENT OF NANOPARTICLES TO BIOMOLECULES PHOSPHO1, EPCAM, EPHA2 LMNA 1796/4885ALDH1A1 2782/4885TDP1 3447/4885

“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.