SCHEMBL1174032

SCHEMBL1174032

CC(CC(=O)O)N1CC1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 1/20 0.37
CYP1A2 P05177 1/20 0.37
REN P00797 1/20 0.35
ACE P12821 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CACNA2D1 P54289 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32

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
SCHEMBL21566774 0.71 ACE (0.56) SMN1; SMN2MAPTCYP1A2RENACE
SCHEMBL1174393 0.70
SCHEMBL4181286 0.70 KDM4E (0.54) SMN1; SMN2ALDH1A1MAPTL3MBTL1HTT
SCHEMBL3940485 0.70
Hydrochloric Acid SCHEMBL8401126 0.68 SLC6A9 (0.46) SMN1; SMN2MAPTCYP1A2KDM4ESLC6A9
SCHEMBL1144230 0.68 SLC6A9 (0.46) SMN1; SMN2ALDH1A1MAPTCYP1A2KDM4E
SCHEMBL28713642 0.68 SLC6A9 (0.46) SMN1; SMN2ALDH1A1MAPTCYP1A2KDM4E
SCHEMBL21566754 0.68 SMN1; SMN2 (0.47) SMN1; SMN2MAPTCYP1A2RENACE
SCHEMBL21525634 0.68 KDM4E (0.39) ALDH1A1MAPTL3MBTL1HTTREN
SCHEMBL9819640 0.67

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-20110039107-A1 FILM PRIMER WITH IMPROVED ADHESION SIKA TECHNOLOGY AG (CH) 2011-02-17 US disclosed