SCHEMBL9828158

SCHEMBL9828158

CCN1C(C)=C(OC(=O)OC(C)C)C(c2sccc2Cl)C2=C1COC2=O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PYGM P11217 4/20 0.35
PYGL P06737 3/20 0.35

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
SCHEMBL9828735 0.91 KDM4E (0.36) PYGMPYGL
SCHEMBL9827653 0.88 PYGM (0.35) PYGMPYGL
SCHEMBL10424875 0.87 PYGM (0.46) PYGMPYGL
SCHEMBL10374452 0.85 PYGM (0.36) PYGMPYGL
SCHEMBL9829022 0.85 PYGL (0.48) PYGMPYGL
SCHEMBL10968852 0.81 PYGM (0.37) PYGMPYGL
SCHEMBL9829012 0.79 KDM4E (0.33)
SCHEMBL9830677 0.79 ALDH1A1 (0.41)
SCHEMBL10969370 0.78 PYGM (0.35) PYGMPYGL
SCHEMBL10425201 0.78 PYGM (0.45) PYGMPYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0229963-B1 4-THIENYL-DIHYDROPYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PREPARATIONS BAYER AG (DE) 1991-09-11 EP disclosed
EP-0229963-A2 4-Thienyl-dihydropyridines, process for their preparation and their use as pharmaceutical preparations BAYER AG (DE) 1987-07-29 EP disclosed