SCHEMBL4953347

SCHEMBL4953347

CCCCSCC(NC(C)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICMT O60725 1/20 0.49
MAPT P10636 3/20 0.47
THRB P10828 2/20 0.47
BLM P54132 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALOX15 P16050 1/20 0.47
NFKB1 P19838 1/20 0.47
PTGS2 P35354 1/20 0.47
THPO P40225 1/20 0.47
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 2/20 0.47
CES2 O00748 1/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NOD1 Q9Y239 1/20 0.41
CES1 P23141 1/20 0.40

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
SCHEMBL9545188 0.93 ICMT (0.53) ICMTMAPTTHRBBLMKDM4E
SCHEMBL19927710 0.93 ICMT (0.53) ICMTMAPTTHRBBLMKDM4E
SCHEMBL9117736 0.93 ICMT (0.53) ICMTMAPTTHRBBLMKDM4E
SCHEMBL9119016 0.93 ICMT (0.53) ICMTMAPTTHRBBLMKDM4E
SCHEMBL19927712 0.93 ICMT (0.53) ICMTMAPTTHRBBLMKDM4E
SCHEMBL9545182 0.93 ICMT (0.53) ICMTMAPTTHRBBLMKDM4E
SCHEMBL21144523 0.91 MAPT (0.52) ICMTMAPTTHRBBLMKDM4E
SCHEMBL14991078 0.89 MAPT (0.50) ICMTMAPTTHRBBLMKDM4E
SCHEMBL4956217 0.89 MAPT (0.50) ICMTMAPTTHRBBLMKDM4E
SCHEMBL10043024 0.86 MAPT (0.47) ICMTMAPTTHRBBLMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465471-B2 Palatability of aquaculture feed NOVUS INTERNATIONAL, INC. (US) 2008-12-16 US disclosed
WO-2007147155-A1 POLYOL ESTER COMPOUNDS NOVUS INTERNATIONAL INC. (US) 2007-12-21 WO disclosed
US-20070292485-A1 POLYOL ESTER COMPOUNDS NOVUS INTERNATIONAL INC. (US) 2007-12-20 US disclosed
US-20050215623-A1 Palatability of aquaculture feed NOVUS INTERNATIONAL, INC. (US) 2005-09-29 US disclosed
EP-1531672-A2 ANTIMICROBIAL COMPOSITIONS Novus International, Inc. (US) 2005-05-25 EP disclosed
US-20040175434-A1 Antimicrobial compositions NOVUS INTERNATIONAL, INC. 2004-09-09 US disclosed
WO-2004019683-A2 ANTIMICROBIAL COMPOSITIONS NOVUS INTERNATIONAL, INC. (US) 2004-03-11 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 (3 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-20070292485-A1 POLYOL ESTER COMPOUNDS PNLIP, ELOVL1, ELOVL5 ICMT 1514/4885MAPT 2966/4885THRB 2630/4885
US-20050215623-A1 Palatability of aquaculture feed TAS2R3, TAS2R1, TAS2R20 ICMT 2231/4885MAPT 4862/4885THRB 1916/4885
US-20040175434-A1 Antimicrobial compositions MRPL21, FPR1, ARG1 ICMT 1467/4885MAPT 4525/4885THRB 4021/4885

“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.