SCHEMBL4789533

SCHEMBL4789533

CCCCC(O)(C(N)=O)N1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.34
ADAM17 P78536 1/20 0.33
BCHE P06276 1/20 0.32
HPGD P15428 1/20 0.32
FDPS P14324 1/20 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
SCHEMBL9698366 0.79 L3MBTL1 (0.40) L3MBTL1MEN1KMT2ATDP1ALDH1A1
SCHEMBL4559646 0.74 GNAI3 (0.34) KMT2A
SCHEMBL9697372 0.73 LMNA (0.36) L3MBTL1MEN1KMT2ATDP1ALDH1A1
Hydrochloric Acid SCHEMBL9697223 0.71 LMNA (0.35) L3MBTL1MEN1KMT2ATDP1ALDH1A1
SCHEMBL5816021 0.70 CYP2B6 (0.43) KMT2AMAPT
SCHEMBL19799122 0.70 L3MBTL1 (0.34) L3MBTL1MEN1KMT2ATDP1FDPS
SCHEMBL1077277 0.68 SIGMAR1 (0.33) KMT2A
SCHEMBL23032951 0.67 L3MBTL1 (0.35) L3MBTL1MEN1KMT2ATDP1ALDH1A1
SCHEMBL21677383 0.67 L3MBTL1 (0.35) L3MBTL1MEN1KMT2ATDP1ALDH1A1
SCHEMBL21440013 0.67 L3MBTL1 (0.35) L3MBTL1MEN1KMT2ATDP1ALDH1A1

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
WO-2008124575-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO disclosed