SCHEMBL8905884

SCHEMBL8905884

CCC([O])CN1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
ALDH1A1 P00352 5/20 0.48
ANPEP P15144 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 4/20 0.38
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 2/20 0.38
TSHR P16473 2/20 0.37
GAA P10253 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL12058898 0.77 USP2 (0.54) USP2ALDH1A1ANPEPL3MBTL1LMNA
SCHEMBL7244900 0.77 ALDH1A1 (0.57) USP2ALDH1A1ANPEPL3MBTL1LMNA
SCHEMBL11627436 0.77 USP2 (0.54) USP2ALDH1A1ANPEPL3MBTL1LMNA
SCHEMBL10192059 0.76 USP2 (0.52) USP2ALDH1A1ANPEPL3MBTL1LMNA
SCHEMBL15354727 0.76 USP2 (0.52) USP2ALDH1A1ANPEPL3MBTL1LMNA
SCHEMBL3954978 0.74 USP2 (0.50) USP2ALDH1A1ANPEPL3MBTL1KDM4E
SCHEMBL4348780 0.74 USP2 (0.50) USP2ALDH1A1ANPEPL3MBTL1LMNA
SCHEMBL2607193 0.74 USP2 (0.75) USP2ALDH1A1L3MBTL1KDM4EHSD17B10
SCHEMBL17393142 0.74 L3MBTL1 (0.45) USP2ALDH1A1L3MBTL1KDM4EALOX12
SCHEMBL19059680 0.72 USP2 (0.72) USP2ALDH1A1L3MBTL1KDM4EHSD17B10

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-5654445-A INTERMEDIATES FOR RENIN INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-08-05 US disclosed