SCHEMBL23400112

SCHEMBL23400112

CCc1c(O)cnn1C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NR4A3 Q92570 1/20 0.30

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
SCHEMBL23399188 0.85 NPC1 (0.30)
SCHEMBL23403541 0.82 NPC1 (0.34)
SCHEMBL23402244 0.79 KDM4E (0.33)
SCHEMBL23399649 0.74
SCHEMBL23399663 0.72 CYP17A1 (0.32)
SCHEMBL23400603 0.72 GABRA1 (0.35)
SCHEMBL23399104 0.71 KDM4E (0.31)
SCHEMBL23400969 0.71 HTT (0.38) NR4A3
SCHEMBL23402384 0.68 ALOX15 (0.31) NR4A3
SCHEMBL23402017 0.68 POLB (0.41) NR4A3

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