SCHEMBL23401218

SCHEMBL23401218

Cc1ccccc1-n1[nH]c(-c2ccccc2)c(C(C)(C)C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALKBH3 Q96Q83 2/20 0.38
GAA P10253 2/20 0.37
ALOX15 P16050 1/20 0.37
MPL P40238 1/20 0.36
MGLL Q99685 1/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
JAK3 P52333 1/20 0.36
HPGD P15428 1/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 3/20 0.35
POLB P06746 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPT P10636 3/20 0.34
NOX4 Q9NPH5 2/20 0.34

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
SCHEMBL23398850 0.92 ALKBH3 (0.36) MEN1KMT2AALKBH3GAAMPL
SCHEMBL23400441 0.88 ALKBH3 (0.37) MEN1KMT2AALKBH3GAAMPL
SCHEMBL23402989 0.86 MAPT (0.38) MEN1KMT2AGAAMPLMGLL
SCHEMBL23400710 0.85 ALKBH3 (0.49) MEN1KMT2AALKBH3GAAALOX15
SCHEMBL23399338 0.82 MPL (0.44) MEN1KMT2AGAAALOX15MPL
SCHEMBL23402651 0.82 MEN1 (0.58) MEN1KMT2AGAAALOX15HPGD
SCHEMBL23402768 0.81 MGLL (0.39) MEN1KMT2AGAAMPLMGLL
SCHEMBL23401166 0.81 GAA (0.50) MEN1KMT2AALKBH3GAAALOX15
SCHEMBL23402730 0.80 MEN1 (0.49) MEN1KMT2AALKBH3GAAALOX15
SCHEMBL23402976 0.77 ALKBH3 (0.47) MEN1KMT2AALKBH3MPLMGLL

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