SCHEMBL11069839

SCHEMBL11069839

CCCCCCCCCCCCCCCC(=O)c1ccccc1[C]=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HTT P42858 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPT P10636 1/20 0.49
ATM Q13315 1/20 0.49
HSD17B3 P37058 6/20 0.46
EPHX2 P34913 1/20 0.45
TSHR P16473 2/20 0.45
LMNA P02545 1/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL7999608 1.00 ALDH1A1 (0.49) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL2356747 1.00 ALDH1A1 (0.49) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL10787348 1.00 ALDH1A1 (0.49) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL936740 0.98 HTT (0.47) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL5614773 0.92 FAAH (0.52) ALDH1A1EPHX2TSHRLMNACES1
SCHEMBL210134 0.86 HPGD (0.44) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL28468474 0.86 TSHR (0.51) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL28464696 0.86 TSHR (0.51) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL10597212 0.86 TSHR (0.51) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL14141727 0.82 CYP19A1 (0.42) ALDH1A1MEN1KMT2AMAPTTSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4427816-A β-Diketone and hydrotalcite stabilizer compositions for halogen-containing polymers and polymer compositions containing the same ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1984-01-24 US disclosed
US-4416797-A Chlorinated organic compounds having their resistance to deterioration enhanced by 1,3-dicarbonyl compounds ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1983-11-22 US disclosed