SCHEMBL4953141

SCHEMBL4953141

CCC(=O)OC(CCSC)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.46
FOLH1 Q04609 6/20 0.36
LMNA P02545 1/20 0.33
MAPK1 P28482 2/20 0.32
ALDH1A1 P00352 3/20 0.31
USP2 O75604 1/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
MEN1 O00255 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL28648380 0.87 RNPEP (0.47) RNPEPFOLH1LMNAMAPK1ALDH1A1
SCHEMBL4952847 0.86 RNPEP (0.43) RNPEPFOLH1LMNAMAPK1ALDH1A1
SCHEMBL4954245 0.85 RNPEP (0.46) RNPEPFOLH1LMNAMAPK1ALDH1A1
SCHEMBL4951805 0.84 TSHR (0.37) METAP2METAP1MEN1CYP2C19RECQL
SCHEMBL4955492 0.82 MEN1 (0.33) RNPEPALDH1A1MEN1CYP2C19RECQL
SCHEMBL4951966 0.82 BHMT (0.34) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL18354070 0.82 LMNA (0.49) LMNAMAPK1ALDH1A1TP53MEN1
SCHEMBL9332345 0.81 RNPEP (0.48) RNPEPFOLH1LMNAMAPK1ALDH1A1
SCHEMBL2820915 0.81 RNPEP (0.48) RNPEPFOLH1LMNAMAPK1ALDH1A1
SCHEMBL2820920 0.81 RNPEP (0.48) RNPEPFOLH1LMNAMAPK1ALDH1A1

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 RNPEP 3086/4885FOLH1 1682/4885LMNA 1572/4885
US-20050215623-A1 Palatability of aquaculture feed TAS2R3, TAS2R1, TAS2R20 RNPEP 1217/4885FOLH1 2075/4885LMNA 4474/4885
US-20040175434-A1 Antimicrobial compositions MRPL21, FPR1, ARG1 RNPEP 2140/4885FOLH1 4314/4885LMNA 2272/4885

“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.