SCHEMBL6863950

SCHEMBL6863950

C=CC(=O)NCCC(=O)C(=C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
TSHR P16473 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.36
TGM2 P21980 6/20 0.33
BBOX1 O75936 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32

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
SCHEMBL28612357 0.89 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL2059656 0.81 ZDHHC20 (0.53) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Methacrylic Acid SCHEMBL7039406 0.80 ZDHHC20 (0.48) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL21845015 0.79 KDM4E (0.48) TSHRALDH1A1MAPK1MTNR1AMTNR1B
Urea SCHEMBL29002144 0.78 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL28520089 0.78 BBOX1 (0.31) BBOX1
SCHEMBL9238864 0.78 TDP1 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL17239830 0.78 ZDHHC20 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL19880119 0.78 ZDHHC20 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL21127497 0.77 ZDHHC20 (0.53) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1

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 ZDHHC20 779/4885ZDHHC2 164/4885TSHR 4643/4885

“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.