SCHEMBL23398652

SCHEMBL23398652

CCCc1c(C)c(O)nn1CC(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
MAPK14 Q16539 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
SCHEMBL23403705 0.90 FFAR1 (0.33) SMN1; SMN2
SCHEMBL23399079 0.86 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL23398849 0.83
SCHEMBL23399950 0.82 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL23402463 0.82 FFAR1 (0.36) MAPK14
SCHEMBL23402538 0.82 ADORA2A (0.32)
SCHEMBL23402750 0.81 GLA (0.31)
SCHEMBL23401463 0.80 ADORA2A (0.34)
SCHEMBL23402537 0.80
SCHEMBL23403443 0.79 SMN1; SMN2 (0.38) SMN1; SMN2MAPK14

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