SCHEMBL13073645

SCHEMBL13073645

CCCCCCCCCCCCCCCC(=O)OCC(COC(c1ccccc1)(c1ccccc1)c1ccc(C(=O)N2C(=O)C=CC2=O)cc1)OC(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
PRKCA P17252 1/20 0.43
PRKCE Q02156 1/20 0.43
PRKCQ Q04759 1/20 0.43
PRKCD Q05655 1/20 0.43
LPAR3 Q9UBY5 7/20 0.42
LPAR1 Q92633 4/20 0.42
ENPP2 Q13822 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TLR2 O60603 5/20 0.42
LPAR2 Q9HBW0 2/20 0.41

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
SCHEMBL13073485 0.82 ALDH1A1 (0.46) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL13073172 0.82 ALDH1A1 (0.46) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL13073131 0.80 ALDH1A1 (0.48) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL974889 0.79 PRKCA (0.59) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL978433 0.79 PRKCA (0.59) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL975774 0.79 PRKCA (0.59) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL8014258 0.78 PRKCA (0.54) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL13073129 0.77 ALDH1A1 (0.43) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL13073644 0.76 TK2 (0.41)
SCHEMBL4068257 0.76 PRKCA (0.53) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9034798-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2015-05-19 US disclosed
US-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-11-25 US disclosed
US-20100248264-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-09-30 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-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CHLSN, PTMS, SRMS ALDH1A1 4064/4885LMNA 1430/4885PRKCA 3370/4885

“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.