SCHEMBL23399604

SCHEMBL23399604

Cc1cccc(-n2nc(CC(C)C)c(C(C)(C)C)c2O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 1/20 0.41
MAPK14 Q16539 2/20 0.41
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
ALDH1A1 P00352 4/20 0.39
MAPK9 P45984 1/20 0.39
DDR2 Q16832 1/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RPA1 P27694 1/20 0.36
PRKCZ Q05513 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
KCNJ6 P48051 1/20 0.34
KCNJ5 P48544 1/20 0.34
KCNJ3 P48549 1/20 0.34
HSD11B1 P28845 1/20 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
SCHEMBL23401635 0.86 MAPK14 (0.46) RIPK2MAPK14MAPK13MAPK12MAPK11
SCHEMBL23401845 0.85 CACNA1H (0.39) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL23402290 0.84 ALDH1A1 (0.42) RIPK2MAPK14MAPK13MAPK12MAPK11
SCHEMBL23400882 0.84 CDK8 (0.39) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL23401756 0.84 MAPK13 (0.38) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL23401578 0.84 RIPK2 (0.42) RIPK2MAPK14MAPK13MAPK12MAPK11
SCHEMBL23399099 0.83 ALDH1A1 (0.41) RIPK2MAPK14MAPK13MAPK12MAPK11
SCHEMBL23402635 0.82 RIPK2 (0.41) RIPK2MAPK14MAPK13MAPK12MAPK11
SCHEMBL23399286 0.82 ALDH1A1 (0.40) RIPK2MAPK14MAPK13MAPK12MAPK11
SCHEMBL23403090 0.81 RIPK2 (0.40) RIPK2MAPK14MAPK13MAPK12MAPK11

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