SCHEMBL6864093

SCHEMBL6864093

C=CC(=O)CCNC(=O)C(=C)C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
TGFBR1 P36897 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PLA2G2A P14555 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
SCHEMBL15535068 0.79 ALDH1A1 (0.41) ALDH1A1TSHRTGFBR1MAPK1TDP1
SCHEMBL316224 0.78 TGFBR1 (0.41) ALDH1A1TSHRTGFBR1MAPK1TDP1
SCHEMBL19880119 0.78 ZDHHC20 (0.50) ALDH1A1TSHRTGFBR1ZDHHC20ZDHHC2
SCHEMBL17239830 0.78 ZDHHC20 (0.50) ALDH1A1TSHRTGFBR1ZDHHC20ZDHHC2
SCHEMBL13205118 0.77 PLA2G2A (0.36) ALDH1A1TGFBR1MAPK1TDP1PLA2G2A
SCHEMBL907324 0.77 PLA2G2A (0.48) ALDH1A1TGFBR1PLA2G2A
SCHEMBL23031131 0.76 TSHR (0.55) ALDH1A1TSHR
SCHEMBL2858627 0.75 ALDH1A1 (0.34) ALDH1A1TSHRTGFBR1ZDHHC20ZDHHC2
SCHEMBL6402194 0.75 TDP1 (0.40) ALDH1A1TGFBR1MAPK1TDP1PLA2G2A
SCHEMBL10386869 0.74 ZDHHC20 (0.56) ALDH1A1TSHRZDHHC20ZDHHC2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6818718-B2 IMPROVED SEPARATION OF PROTEINS, ENZYMES, PEPTIDES, OLIGONUCLEOTIDES, POLYNUCLEOTIDES, AND CARBOHYDRATES THE UNIVERSITY OF MELBOURNE (AU) 2004-11-16 US disclosed
US-20010020079-A1 Electrophoresis gels and cross-linking agents for their preparation THE UNIVERSITY OF MELBOURNE 2001-09-06 US disclosed
US-6197906-B1 ASSYMETRIC AGENTS SUCH AS (2-METHACRYLOYLOXYETHYL)ACRYLAMIDE, (2-ACRYLOYLOXYETHYL)METHACRYLAMIDE, AND (N-METHYL-N-ACRYLOYLAMINO)ETHYL METHACRYLATE THE UNIVERSITY OF MELBOURNE (AU) 2001-03-06 US disclosed
EP-0920412-A4 ELECTROPHORESIS GELS AND CROSS-LINKING AGENTS FOR THEIR PREPARATION UNIV MELBOURNE (AU) 2000-08-02 EP disclosed
EP-0920412-A1 ELECTROPHORESIS GELS AND CROSS-LINKING AGENTS FOR THEIR PREPARATION THE UNIVERSITY OF MELBOURNE (AU) 1999-06-09 EP disclosed
WO-1998001419-A1 ELECTROPHORESIS GELS AND CROSS-LINKING AGENTS FOR THEIR PREPARATION THE UNIVERSITY OF MELBOURNE (AU) 1998-01-15 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 (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-20010020079-A1 Electrophoresis gels and cross-linking agents for their preparation MACF1, ZYX, F12 ALDH1A1 794/4885TSHR 4643/4885TGFBR1 3325/4885

“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.