SCHEMBL3021223

SCHEMBL3021223

[CH2]C(O)CN(CCCCC(N)C(=O)OCC)CC(COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ PRKCA P17252 2/20 0.47
▸ PRKCE Q02156 2/20 0.47
▸ PRKCQ Q04759 2/20 0.47
▸ PRKCD Q05655 2/20 0.47
▸ TLR2 O60603 3/20 0.47
▸ LPAR3 Q9UBY5 7/20 0.46
▸ LPAR1 Q92633 4/20 0.46
▸ ENPP2 Q13822 3/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ LPAR2 Q9HBW0 2/20 0.45

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
SCHEMBL3388986 1.00 ALDH1A1 (0.53) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3391141 1.00 ALDH1A1 (0.53) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3030032 0.95 ALDH1A1 (0.59) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3027166 0.95 ALDH1A1 (0.59) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3038002 0.93 LMNA (0.54) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3040870 0.93 LMNA (0.54) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3035045 0.92 ALDH1A1 (0.53) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3388940 0.92 ALDH1A1 (0.53) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3034572 0.92 ALDH1A1 (0.53) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3027565 0.90 ALDH1A1 (0.50) ALDH1A1LMNAPRKCAPRKCEPRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100202998-A1 USE OF AT LEAST ONE LYSINE-DERIVED COMPOUND FOR THE CONDITIONING OF KERATINOUS FIBERS, COSMETIC COMPOSITION COMPRISING IT AND METHOD FOR CONDITIONING THE FIBERS L'OREAL S.A. (FR) 2010-08-12 — — US claimed

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-20100202998-A1 USE OF AT LEAST ONE LYSINE-DERIVED COMPOUND FOR THE CONDITIONING OF KERATINOUS FIBERS, COSMETIC COMPOSITION COMPRISING IT AND METHOD FOR CONDITIONING THE FIBERS KRT18, DSG1, PLOD3 ALDH1A1 674/4885LMNA 520/4885PRKCA 322/4885

“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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