SCHEMBL4785482

SCHEMBL4785482

COCCCCC(O)C(=O)N1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
LIPE Q05469 1/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CNR2 P34972 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
DPP4 P27487 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL4786703 0.84 CYP3A4 (0.41) ALDH1A1TDP1CYP2C19L3MBTL1KMT2A
SCHEMBL28455412 0.80 GPR84 (0.52) TDP1L3MBTL1KMT2AMEN1
SCHEMBL8489074 0.75 L3MBTL1 (0.44) DPP7MMP1MMP2MMP8ALDH1A1
SCHEMBL8487636 0.73 L3MBTL1 (0.42) DPP7MMP1MMP2MMP8TDP1
SCHEMBL28910831 0.72 KDM4E (0.39) ALDH1A1TDP1CNR2KMT2AMEN1
SCHEMBL4440119 0.71 KMT2A (0.62) ALDH1A1TDP1L3MBTL1KMT2AMEN1
SCHEMBL3124110 0.71 GPR84 (0.57) ALDH1A1SMN1; SMN2
SCHEMBL4560650 0.71 MMP1 (0.44) DPP7MMP1MMP2MMP8ALDH1A1
SCHEMBL18959431 0.70 MMP1 (0.41) DPP7MMP1MMP2MMP8LIPE
SCHEMBL31686221 0.70 MMP1 (0.41) DPP7MMP1MMP2MMP8LIPE

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-2008124582-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO disclosed