SCHEMBL23398574

SCHEMBL23398574

CCc1[nH]n(-c2ccccc2C)c(=O)c1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
NOX4 Q9NPH5 1/20 0.37
MPL P40238 1/20 0.36
MGLL Q99685 2/20 0.36
ALOX5 P09917 2/20 0.34
MT-CO1 P00395 1/20 0.34
MT-CO2 P00403 1/20 0.34
MAPT P10636 3/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PDE7A Q13946 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HCAR1 Q9BXC0 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL23399000 0.89 ELANE (0.36) ELANENOX4MPLMGLLALOX5
SCHEMBL23401119 0.87 KDM4E (0.38) ELANENOX4MPLMGLLALOX5
SCHEMBL23400562 0.85 NOX4 (0.35) ELANENOX4MPLMGLLALOX5
SCHEMBL23401088 0.82 NOX4 (0.42) ELANENOX4MPLMGLLALOX5
SCHEMBL23399338 0.82 MPL (0.44) ELANENOX4MPLMGLLALOX5
SCHEMBL23402768 0.81 MGLL (0.39) ELANENOX4MPLMGLLALOX5
SCHEMBL23402452 0.81 MT-CO1 (0.41) ELANENOX4MPLMGLLALOX5
SCHEMBL23401269 0.81 MT-CO1 (0.49) MT-CO1MT-CO2MAPTKDM4EMEN1
SCHEMBL23401218 0.77 MEN1 (0.39) NOX4MPLMGLLALOX5MAPT
SCHEMBL23400216 0.77 SMN1; SMN2 (0.42) ELANEMT-CO1MT-CO2MAPTKDM4E

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