SCHEMBL28017150

SCHEMBL28017150

Cc1ccc(-n2n[c]cc2CC(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
HTT P42858 3/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
TP53 P04637 2/20 0.34
HSP90AA1 P07900 2/20 0.34
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
NLRP1 Q9C000 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RGS4 P49798 1/20 0.31
RGS8 P57771 1/20 0.31
HIF1A Q16665 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPC1 O15118 2/20 0.31

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
SCHEMBL28016510 0.85 CACNA1H (0.41) ALDH1A1NPSR1GAAHTR6CYP1A2
SCHEMBL28016453 0.81 ALDH1A1 (0.37) MAPTHTTALDH1A1LMNATP53
SCHEMBL5732531 0.73 ALDH1A1 (0.42) MAPTHTTALDH1A1LMNATP53
SCHEMBL23401563 0.70 CACNA1G (0.40) MAPTALDH1A1LMNATP53KDM4E
SCHEMBL28017124 0.67
SCHEMBL28016482 0.67
SCHEMBL23399490 0.65 PPARA (0.35) MAPTHTTALDH1A1LMNATP53
SCHEMBL28017109 0.65 HTR2C (0.31)
SCHEMBL17204928 0.65 NOTUM (0.42) MAPTALDH1A1LMNANPSR1L3MBTL1
SCHEMBL23402173 0.64 KDM4E (0.39) MAPTHTTALDH1A1LMNATP53

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
CN-104684908-A Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL CO 2015-06-03 CN disclosed