SCHEMBL11199769

SCHEMBL11199769

CCc1noc(C(C)C)c1-c1c(C(=O)C(=O)N(C)C)c2ccccc2n1C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.39
SRC P12931 1/20 0.39
TSPO P30536 1/20 0.39
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HK1 P19367 1/20 0.34
HKDC1 Q2TB90 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
SCHEMBL11201159 0.87 TSPO (0.40) EGFRSRCTSPOALDH1A1SMN1; SMN2
SCHEMBL11196148 0.87 TSPO (0.40) EGFRSRCTSPOALDH1A1SMN1; SMN2
SCHEMBL11205941 0.84 TSPO (0.39) EGFRSRCTSPOALDH1A1SMN1; SMN2
SCHEMBL11199117 0.80 TSPO (0.42) EGFRSRCTSPOALDH1A1SMN1; SMN2
SCHEMBL10986654 0.79 ALDH1A1 (0.45) ALDH1A1
SCHEMBL11196021 0.78 SRC (0.39) EGFRSRCTSPOALDH1A1SMN1; SMN2
SCHEMBL11201297 0.78 TSPO (0.40) EGFRSRCTSPOALDH1A1SMN1; SMN2
SCHEMBL11198262 0.78 MYLK (0.35) ALDH1A1NPC1RAB9A
SCHEMBL11197151 0.78 TSPO (0.44) TSPOALDH1A1SMN1; SMN2NPC1MAPT
SCHEMBL11197466 0.77 TSPO (0.41) EGFRSRCTSPOALDH1A1SMN1; SMN2

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
US-4397850-A HYPOGLYCEMIC, ANTIDIABETIC SANDOZ, INC. (US) 1983-08-09 US disclosed