SCHEMBL13685288

SCHEMBL13685288

CSC(C)C=C(C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 3/20 0.32
PTGS1 P23219 1/20 0.31
AKR1C3 P42330 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
SCHEMBL13685287 1.00 APEX1 (0.32) APEX1PTGS1AKR1C3
SCHEMBL13685319 0.79 PTGS1 (0.30) PTGS1AKR1C3
SCHEMBL13685320 0.79 PTGS1 (0.30) PTGS1AKR1C3
SCHEMBL8726421 0.76 PTGS1 (0.37) APEX1PTGS1AKR1C3
SCHEMBL8726425 0.76 PTGS1 (0.37) APEX1PTGS1AKR1C3
SCHEMBL13685272 0.76
SCHEMBL13685089 0.76 PTGS1 (0.32) PTGS1
SCHEMBL13685273 0.76
SCHEMBL3231458 0.76 PTGS1 (0.32) PTGS1
SCHEMBL8863667 0.74 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1776399-B1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIV GENT (BE) 2012-11-14 EP claimed