SCHEMBL2315607

SCHEMBL2315607

CC(C)(NC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1nc(-c2ccccc2)c(Cc2ccccc2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.52
HPGD P15428 4/20 0.52
KMT2A Q03164 4/20 0.52
LMNA P02545 3/20 0.52
MEN1 O00255 3/20 0.52
PLTP P55058 3/20 0.51
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 2/20 0.47
CFTR P13569 5/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
RORC P51449 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
POLB P06746 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL2315616 0.95 PLTP (0.51) SMN1; SMN2HPGDKMT2ALMNAMEN1
SCHEMBL13531700 0.85 PLTP (0.55) SMN1; SMN2HPGDKMT2AMEN1PLTP
SCHEMBL2317849 0.84 PLTP (0.51) SMN1; SMN2HPGDKMT2AMEN1PLTP
SCHEMBL2487506 0.83 PLTP (0.52) SMN1; SMN2KMT2AMEN1PLTPKDM4E
SCHEMBL2490496 0.82 PLTP (0.52) SMN1; SMN2KMT2AMEN1PLTPALDH1A1
SCHEMBL2360023 0.82 TRPV1 (0.49) SMN1; SMN2HPGDKMT2ALMNAMEN1
SCHEMBL2484995 0.82 PLTP (0.51) SMN1; SMN2KMT2APLTPALDH1A1KDM4E
SCHEMBL2485677 0.82 PLTP (0.51) SMN1; SMN2HPGDKMT2ALMNAPLTP
SCHEMBL2488081 0.81 PLTP (0.50) SMN1; SMN2HPGDKMT2APLTPALDH1A1
SCHEMBL2491014 0.81 ADORA1 (0.55) KMT2AMEN1PLTPALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2380631-A1 Heteroaryl derivatives as DGAT1 inhibitors Novartis AG (CH) 2011-10-26 EP disclosed
EP-2349484-A2 HETEROARYL DERIVATIVES AS DGAT1 INHIBITORS Novartis AG (CH) 2011-08-03 EP disclosed
WO-2010007046-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-01-21 WO disclosed