SCHEMBL4378315

SCHEMBL4378315

CC(C)C[C@H](C(=O)OC(C)(C)C)N1C(=O)N(Cc2ccccc2)[C@@](C)(c2ccc(Br)cc2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.35
CNR1 P21554 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.35
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
CALCRL Q16602 1/20 0.33
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP19A1 P11511 1/20 0.32
BCL2 P10415 1/20 0.32
BCL2L2 Q92843 1/20 0.32
MDM2 Q00987 1/20 0.32
OPRD1 P41143 1/20 0.31

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
SCHEMBL6702832 0.89 ABCB1 (0.36) L3MBTL1GAAPOLBMAPTNPSR1
SCHEMBL6702825 0.89 ABCB1 (0.36) L3MBTL1GAAPOLBMAPTNPSR1
SCHEMBL6761592 0.88 MCL1 (0.43) CNR1L3MBTL1GAAMCL1CALCRL
SCHEMBL6761593 0.88 MCL1 (0.43) CNR1L3MBTL1GAAMCL1CALCRL
SCHEMBL6761596 0.88 MCL1 (0.43) CNR1L3MBTL1GAAMCL1CALCRL
SCHEMBL6761598 0.88 MCL1 (0.43) CNR1L3MBTL1GAAMCL1CALCRL
SCHEMBL6702531 0.86 L3MBTL1 (0.33) L3MBTL1GAAPOLBMAPTNPSR1
SCHEMBL6702534 0.86 L3MBTL1 (0.33) L3MBTL1GAAPOLBMAPTNPSR1
SCHEMBL4377560 0.80 GAA (0.42) L3MBTL1GAAKMT2AMCL1CALCRL
SCHEMBL4377559 0.80 GAA (0.42) L3MBTL1GAAKMT2AMCL1CALCRL

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-0903353-B1 Imidazolidine derivates, their preparation and use, and pharmaceutical compositions containing them SANOFI AVENTIS DEUTSCHLAND (DE) 2009-11-25 EP disclosed
EP-0903353-A1 Imidazolidine derivates, their preparation and use, and pharmaceutical compositions containing them Hoechst Marion Roussel Deutschland GmbH (DE) 1999-03-24 EP disclosed