SCHEMBL4955433

SCHEMBL4955433

C=C/C=C/C(=O)NC(CCSC)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
ALDH1A1 P00352 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
FOLH1 Q04609 1/20 0.41
CA2 P00918 2/20 0.41
MAPK1 P28482 2/20 0.41
CA1 P00915 1/20 0.41
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL4955437 1.00 LMNA (0.46) LMNAALDH1A1NPSR1FOLH1CA2
SCHEMBL4951639 0.86 FOLH1 (0.35) LMNAALDH1A1FOLH1
SCHEMBL4951633 0.86 FOLH1 (0.35) LMNAALDH1A1FOLH1
SCHEMBL4954103 0.85 HDAC2 (0.34) LMNAALDH1A1NPSR1FOLH1MAPK1
SCHEMBL4954095 0.85 HDAC2 (0.34) LMNAALDH1A1NPSR1FOLH1MAPK1
SCHEMBL4955528 0.84 HDAC2 (0.36) LMNAALDH1A1NPSR1FOLH1CA2
SCHEMBL4955533 0.84 HDAC2 (0.36) LMNAALDH1A1NPSR1FOLH1CA2
SCHEMBL8185486 0.84 LMNA (0.50) LMNAALDH1A1NPSR1FOLH1CA2
SCHEMBL8185483 0.84 LMNA (0.50) LMNAALDH1A1NPSR1FOLH1CA2
SCHEMBL4955497 0.83 LMNA (0.49) LMNAALDH1A1NPSR1FOLH1CA2

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 5 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
US-20040175434-A1 Antimicrobial compositions NOVUS INTERNATIONAL, INC. 2004-09-09 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 (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 LMNA 1572/4885ALDH1A1 679/4885NPSR1 3569/4885
US-20050215623-A1 Palatability of aquaculture feed TAS2R3, TAS2R1, TAS2R20 LMNA 4474/4885ALDH1A1 585/4885NPSR1 569/4885
US-20040175434-A1 Antimicrobial compositions MRPL21, FPR1, ARG1 LMNA 2272/4885ALDH1A1 2079/4885NPSR1 3793/4885

“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.