SCHEMBL23400823

SCHEMBL23400823

Cc1[nH]n(C(C)C)c(=O)c1CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.33

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
SCHEMBL23401480 0.82 ALDH1A1 (0.35) KDM5A
SCHEMBL23401064 0.81 KDM5A (0.31) KDM5A
SCHEMBL23403419 0.79 KDM4E (0.40) KDM5A
SCHEMBL23399293 0.79 KDM5A (0.30) KDM5A
SCHEMBL23403038 0.78 HPD (0.35) KDM5A
SCHEMBL23399171 0.78 NPC1 (0.37) —
SCHEMBL23399367 0.78 — —
SCHEMBL23398745 0.77 — —
SCHEMBL23403674 0.76 SMN1; SMN2 (0.36) KDM5A
SCHEMBL23399893 0.73 ALDH1A1 (0.33) —

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
Send feedback