SCHEMBL23398446

SCHEMBL23398446

Cc1ccc(-c2[nH]n(-c3ccccc3C)c(=O)c2-c2ccc(C)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALKBH3 Q96Q83 3/20 0.48
KDM4E B2RXH2 2/20 0.42
GAA P10253 3/20 0.41
ALOX15 P16050 1/20 0.41
MAPT P10636 5/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 2/20 0.39
SLC11A2 P49281 3/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAT2A P31153 2/20 0.37
MGLL Q99685 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.36
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NOD2 Q9HC29 1/20 0.35

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
SCHEMBL23400986 0.97 ALKBH3 (0.52) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23401821 0.97 ALKBH3 (0.52) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23401166 0.91 GAA (0.50) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23400255 0.90 MAPT (0.44) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23401701 0.90 ALKBH3 (0.48) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23402976 0.87 ALKBH3 (0.47) ALKBH3KDM4EMAPTLMNAHTT
SCHEMBL23399254 0.87 GAA (0.56) KDM4EGAAALOX15MAPTLMNA
SCHEMBL23399948 0.83 ALKBH3 (0.50) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23401851 0.82 GAA (0.62) ALKBH3KDM4EGAAALOX15MAPT
SCHEMBL23398850 0.82 ALKBH3 (0.36) ALKBH3KDM4EGAAMAPTLMNA

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