SCHEMBL23403304

SCHEMBL23403304

CCc1[nH]n(-c2ccccc2C)c(=O)c1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.55
GAA P10253 5/20 0.47
ALOX15 P16050 1/20 0.47
SLC11A2 P49281 4/20 0.41
MAPT P10636 5/20 0.40
MEN1 O00255 3/20 0.40
HTT P42858 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 2/20 0.39
ELANE P08246 1/20 0.38
TP53 P04637 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NOX4 Q9NPH5 1/20 0.37
HSD17B10 Q99714 1/20 0.36
DCTPP1 Q9H773 1/20 0.36

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
SCHEMBL23398935 0.92 KDM4E (0.47) KDM4EGAAALOX15SLC11A2MAPT
SCHEMBL23401525 0.89 KDM4E (0.49) KDM4EGAAALOX15SLC11A2MAPT
SCHEMBL23401535 0.87 KDM4E (0.58) KDM4EGAAALOX15SLC11A2MAPT
SCHEMBL23401241 0.85 GAA (0.43) KDM4EGAAALOX15SLC11A2MAPT
SCHEMBL23403225 0.82 GAA (0.64) KDM4EGAAALOX15MAPTMEN1
SCHEMBL23401088 0.82 NOX4 (0.42) KDM4EMAPTMEN1KMT2ALMNA
SCHEMBL23401211 0.82 GAA (0.69) KDM4EGAAALOX15SLC11A2MAPT
SCHEMBL23402452 0.81 MT-CO1 (0.41) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL23401166 0.81 GAA (0.50) KDM4EGAAALOX15SLC11A2MAPT
SCHEMBL23403596 0.80 GAA (0.57) KDM4EGAAALOX15SLC11A2MAPT

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