SCHEMBL17083813

SCHEMBL17083813

CCCCCC[C@H](CCCCCCCCCCC(=O)OCCc1ccc(N=C=O)cc1)OC(=O)CCC(=O)OCCc1ccc(OC#N)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 8/20 0.41
▸ CNR2 P34972 4/20 0.39
▸ CNR1 P21554 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ DGKA P23743 1/20 0.36
▸ PRKCA P17252 1/20 0.35
▸ PRKCE Q02156 1/20 0.35
▸ PRKCQ Q04759 1/20 0.35
▸ PRKCD Q05655 1/20 0.35

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
SCHEMBL17083832 0.96 TLR2 (0.40) TLR2CNR2CNR1ALDH1A1LMNA
SCHEMBL17083810 0.93 TLR2 (0.37) TLR2CNR2CNR1ALDH1A1LMNA
SCHEMBL17083828 0.91 PRKCA (0.39) TLR2CNR2CNR1ALDH1A1PRKCA
SCHEMBL17083819 0.91 ALDH1A1 (0.38) TLR2CNR2CNR1ALDH1A1LMNA
SCHEMBL17083805 0.88 PLA2G4B (0.34) TLR2CNR2DGKA
SCHEMBL17083809 0.88 PRKCA (0.39) TLR2CNR2CNR1ALDH1A1PRKCA
SCHEMBL17083873 0.87 KMT2A (0.39) CNR2ALDH1A1LMNAPRKCAPRKCE
SCHEMBL17083820 0.86 TRPV1 (0.37) TLR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL17083830 0.85 ALDH1A1 (0.34) TLR2CNR2ALDH1A1LMNAPRKCA
SCHEMBL17083814 0.84 PLA2G4B (0.39) TLR2CNR2CNR1DGKA

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-9328192-B2 Bio-based monomers and polymers BEZWADA BIOMEDICAL, LLC (US) 2016-05-03 — — US disclosed
US-20150259464-A1 BIO-BASED MONOMERS AND POLYMERS BEZWADA BIOMEDICAL, LLC 2015-09-17 — — 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-20150259464-A1 BIO-BASED MONOMERS AND POLYMERS FHIT, MGAM, BPGM TLR2 1217/4885CNR2 3240/4885CNR1 3969/4885

“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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