SCHEMBL23400830

SCHEMBL23400830

CCCc1nn(C(C)(C)C)c(O)c1CC

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.31
POLB P06746 2/20 0.30
KDM4E B2RXH2 1/20 0.30
TSHR P16473 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
SCHEMBL23402281 0.93 KDM4E (0.30) USP2KDM4ETSHR
SCHEMBL23399976 0.90 NPC1 (0.30)
SCHEMBL23402838 0.88 HPGD (0.34) KDM4ETSHR
SCHEMBL23400825 0.87
SCHEMBL23402206 0.87
SCHEMBL23401371 0.84 NPC1 (0.31) KDM4E
SCHEMBL23398961 0.83
SCHEMBL23402582 0.82 HPGD (0.35) KDM4ETSHR
SCHEMBL23400597 0.81 HPGD (0.34) KDM4ETSHR
SCHEMBL23399217 0.80 TSHR (0.31) TSHR

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