SCHEMBL29874375

SCHEMBL29874375

C=CN(C=C)[C@@H](C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 2/20 0.31
SLC7A5 Q01650 1/20 0.31

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
SCHEMBL8598766 0.88 TP53 (0.32) TP53
SCHEMBL15053534 0.75 TP53 (0.33) TP53TSHR
SCHEMBL27484821 0.74 TP53 (0.36) TP53SLC7A5
SCHEMBL28148643 0.74 TP53 (0.36) TP53SLC7A5
SCHEMBL11293869 0.73 TP53 (0.32) TP53ALDH1A1
Propene SCHEMBL27710736 0.72 TP53 (0.35) TP53TSHRLMNA
SCHEMBL17665961 0.69 TSHR (0.33) TP53TSHRLMNAALDH1A1
SCHEMBL2550190 0.69 SMPD2 (0.41) TP53TSHRLMNAALDH1A1
SCHEMBL607777 0.69 ALDH1A1 (0.35) TP53TSHRLMNAALDH1A1
SCHEMBL27695608 0.69 TSHR (0.33) TP53TSHRLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4034122-B1 METHODS FOR TREATING HYPERPHENYLALANINEMIA PTC THERAPEUTICS MP INC (US) 2025-08-13 EP claimed
EP-3758487-B1 METHOD FOR CONTROLLING PATHOGENIC INFECTION OF PLANTS THE STATE OF ISRAEL MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT AGRICULTURAL RES ORGANIZATION ARO VO (IL) 2023-08-30 EP claimed
EP-4058566-A1 ADAPTER SYSTEM FOR NONRIBOSOMAL PEPTIDE SYNTHETASES AND POLYKETIDE SYNTHASES Johann-Wolfgang-Goethe-Universität Frankfurt am Main (DE) 2022-09-21 EP disclosed