SCHEMBL14530626

SCHEMBL14530626

NC(=O)C(N)CCCCNOCCOCCOCCOCCNC(=O)CCS

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 6/20 0.34
▸ CA1 P00915 5/20 0.34
▸ CA9 Q16790 5/20 0.34
▸ CA12 O43570 4/20 0.34
▸ CA4 P22748 4/20 0.34
▸ CA14 Q9ULX7 4/20 0.34
▸ GLP1R P43220 8/20 0.32
▸ HDAC3 O15379 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC7 Q8WUI4 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ HDAC10 Q969S8 1/20 0.31
▸ HDAC11 Q96DB2 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HDAC9 Q9UKV0 1/20 0.31
▸ HDAC5 Q9UQL6 1/20 0.31
▸ TLR2 O60603 1/20 0.31
▸ EPOR P19235 1/20 0.30

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
SCHEMBL14530622 0.87 GLP1R (0.42) CA2CA1CA9CA12CA4
SCHEMBL24864669 0.77 EPOR (0.43) CA2CA1CA9CA12CA4
SCHEMBL13539399 0.74 GLP1R (0.46) GLP1RHDAC3HDAC4HDAC1HDAC7
SCHEMBL19049679 0.73 GLP1R (0.52) GLP1REPOR
SCHEMBL13882421 0.73 GLP1R (0.45) CA2CA1CA9CA12CA4
SCHEMBL14530627 0.72 GLP1R (0.42) CA2CA1CA9CA12CA4
SCHEMBL20976640 0.72 GLP1R (0.50) GLP1R
SCHEMBL23505676 0.72 GLP1R (0.58) GLP1R
SCHEMBL13640939 0.72 GLP1R (0.41) GLP1RMEN1KMT2A
SCHEMBL13640888 0.72 GLP1R (0.43) GLP1RMEN1KMT2A

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-2007049940-A1 BIOACTIVE SUBSTANCE-BLOOD PROTEIN CONJUGATE AND STABILIZATION OF A BIOACTIVE SUBSTANCE USING THE SAME PEPTRON CO., LTD (KR) 2007-05-03 — — WO disclosed
Send feedback