SCHEMBL13748239

SCHEMBL13748239

Cc1ccc(-c2[nH]c([C@@H]3CCCN3C(=O)OC(C)(C)C)nc2C(=O)OCc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PRCP P42785 2/20 0.42
PRMT5 O14744 5/20 0.42
NPSR1 Q6W5P4 2/20 0.41
MAPT P10636 1/20 0.41
KLK7 P49862 1/20 0.41
GFER P55789 1/20 0.41
GPR119 Q8TDV5 1/20 0.40
PARP1 P09874 1/20 0.39
AADAT Q8N5Z0 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL12159694 0.93 PRMT5 (0.42) MEN1KMT2APRCPPRMT5KLK7
SCHEMBL13747169 0.90 MEN1 (0.47) MEN1KMT2APRCPNPSR1MAPT
SCHEMBL1746174 0.89 PRCP (0.52) PRCP
SCHEMBL13748237 0.86 NPSR1 (0.45) MEN1KMT2ANPSR1MAPTL3MBTL1
SCHEMBL12159693 0.83 KMT2A (0.45) MEN1KMT2AMAPT
SCHEMBL27780183 0.83 KMT2A (0.45) MEN1KMT2AMAPT
SCHEMBL13747705 0.83 MEN1 (0.45) MEN1KMT2ANPSR1MAPTGPR119
SCHEMBL15412011 0.82 HPGDS (0.54) PRCPPRMT5GPR119
SCHEMBL13758845 0.82 NPSR1 (0.42) KMT2APRCPNPSR1MAPTGPR119
SCHEMBL1747101 0.79 CYP3A4 (0.49) MEN1KMT2APRCP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009102325-A1 IMIDAZOLYL BIPHENYL IMIDAZOLES AS HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-20 WO disclosed
WO-2009102318-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-20 WO disclosed
WO-2008021936-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 WO disclosed
WO-2008021928-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 WO disclosed
WO-2008021927-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 WO disclosed