SCHEMBL23399082

SCHEMBL23399082

CC(C)Cc1c[nH]n(C(C)(C)C)c1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.32
DAO P14920 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
SCHEMBL23402148 0.83 GRIN2D (0.31)
SCHEMBL23399545 0.76 DAO (0.31) KDM5ADAO
SCHEMBL23400488 0.76 GABRA1 (0.36) KDM5ADAO
SCHEMBL23399751 0.74 KDM5A (0.33) KDM5ADAO
SCHEMBL23402317 0.74 CTRC (0.33) DAO
SCHEMBL23399233 0.73 SMN1; SMN2 (0.34) KDM5ADAO
SCHEMBL23400475 0.73 ALDH1A1 (0.33) KDM5ADAO
SCHEMBL23402424 0.72 KDM5A (0.34) KDM5A
SCHEMBL23398383 0.70 ALDH1A1 (0.49) KDM5A
SCHEMBL23400010 0.69 GAA (0.35)

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