SCHEMBL5722571

SCHEMBL5722571

CC(=O)Nc1cccc(COc2c(Cl)cc(CC(=O)OC(=O)CNC(=O)c3cc(Cl)c(OCc4cccc(NC(C)=O)c4)c(Cl)c3)cc2Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SENP5 Q96HI0 3/20 0.44
SENP2 Q9HC62 3/20 0.44
SENP1 Q9P0U3 3/20 0.44
USP2 O75604 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
SIRT2 Q8IXJ6 2/20 0.43
SIRT3 Q9NTG7 2/20 0.43
CLCN2 P51788 1/20 0.42
SIRT1 Q96EB6 1/20 0.41
PLAU P00749 2/20 0.40
MRGPRX4 Q96LA9 2/20 0.39
MAOB P27338 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL5722819 0.92 SENP5 (0.46) SENP5SENP2SENP1MEN1KMT2A
SCHEMBL5718006 0.91 PLAU (0.40) SENP5SENP2SENP1MEN1KMT2A
SCHEMBL5717977 0.90 MRGPRX4 (0.42) SENP5SENP2SENP1MEN1KMT2A
SCHEMBL5722619 0.90 SENP5 (0.46) SENP5SENP2SENP1MEN1KMT2A
SCHEMBL5722544 0.89 LMNA (0.37) SENP5SENP2SENP1USP2MEN1
SCHEMBL5722563 0.88 SENP5 (0.46) SENP5SENP2SENP1USP2MEN1
SCHEMBL5722487 0.88 ALDH1A1 (0.35) SENP5SENP2SENP1USP2MEN1
SCHEMBL5718130 0.87 MRGPRX4 (0.41) MEN1KMT2ARAB9ANPC1MRGPRX4
SCHEMBL5119979 0.86 MEN1 (0.50) SENP5SENP2SENP1USP2MEN1
SCHEMBL5722554 0.85 RHOC (0.39) MRGPRX4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732532-A1 NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING AGONISTS OF THE THYROID RECEPTOR KARO BIO AB (SE) 2006-12-20 EP disclosed
WO-2005092316-A1 NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING AGONISTS OF THE THYROID RECEPTOR KARO BIO AB (SE) 2005-10-06 WO disclosed