SCHEMBL23399449

SCHEMBL23399449

Cc1c(O)nn(CC(C)C)c1C(C)C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
APAF1 O14727 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
SCHEMBL23399265 0.82 ADORA2A (0.32)
SCHEMBL23399089 0.80 APAF1 (0.44) SMN1; SMN2APAF1
SCHEMBL23399303 0.79 ADORA2A (0.33)
SCHEMBL23403547 0.78
SCHEMBL23400413 0.78
SCHEMBL23401418 0.77 SMN1; SMN2 (0.41) SMN1; SMN2APAF1
SCHEMBL23399881 0.77
SCHEMBL23399588 0.77 NR1H3 (0.33)
SCHEMBL23399950 0.76 SMN1; SMN2 (0.33) SMN1; SMN2APAF1
SCHEMBL23399079 0.76 SMN1; SMN2 (0.33) SMN1; SMN2APAF1

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed