SCHEMBL5015534

SCHEMBL5015534

C=CCCCCCCCCCOCC(COC(C)=O)OC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.52
CYP3A4 P08684 2/20 0.52
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
RECQL P46063 1/20 0.52
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
PLA2G2C Q5R387 1/20 0.47
PRKCA P17252 3/20 0.43
ADRA1D P25100 1/20 0.42
PTAFR P25105 1/20 0.42
HTR1D P28221 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1B P35368 1/20 0.42
DRD3 P35462 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42

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
SCHEMBL8746900 0.85 PLA2G2C (0.53) USP2CYP3A4MAPTSMN1; SMN2LMNA
SCHEMBL2232552 0.85 PLA2G2C (0.53) USP2CYP3A4MAPTSMN1; SMN2LMNA
SCHEMBL1506794 0.84 PRKCA (0.61) PRKCAADRA1DPTAFRHTR1DHTR2C
SCHEMBL1506792 0.84 PRKCA (0.61) PRKCAADRA1DPTAFRHTR1DHTR2C
SCHEMBL10894210 0.83 ADRA1D (0.55) USP2LMNAALDH1A1PLA2G2CPRKCA
SCHEMBL10824976 0.83 ADRA1D (0.55) USP2LMNAALDH1A1PLA2G2CPRKCA
SCHEMBL8438758 0.83 ADRA1D (0.55) USP2LMNAALDH1A1PLA2G2CPRKCA
SCHEMBL8435468 0.83 ADRA1D (0.55) USP2LMNAALDH1A1PLA2G2CPRKCA
SCHEMBL5017334 0.82 PRKCA (0.47) USP2LMNAALDH1A1PLA2G2CPRKCA
SCHEMBL14036738 0.81 ADRA1D (0.44) MAPTLMNAALDH1A1PLA2G2CPRKCA

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
EP-1465876-B1 LONG CHAIN FATTY ALCOHOL SUBSTITUENTS IN ANTINEOPLASTIC AGENTS PFAENDLER HANS RUDOLF (DE) 2008-11-05 EP disclosed
EP-1465876-B1 LONG CHAIN FATTY ALCOHOL SUBSTITUENTS IN ANTINEOPLASTIC AGENTS PFAENDLER HANS RUDOLF (DE) 2008-11-05 EP disclosed
US-20040266747-A1 Long chain fatty alcohol substituents in antineoplastic agents PFAENDLER HANS R (DE) 2004-12-30 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-20040266747-A1 Long chain fatty alcohol substituents in antineoplastic agents FASN, ELOVL3, ELOVL1 USP2 1052/4885CYP3A4 516/4885MAPT 4242/4885

“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.