SCHEMBL6013407

SCHEMBL6013407

CCCCCc1cccc(C(N)=O)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.48
MCL1 Q07820 3/20 0.48
PPARA Q07869 3/20 0.48
BCL2L1 Q07817 2/20 0.48
BAK1 Q16611 2/20 0.48
KAT8 Q9H7Z6 2/20 0.48
PPARG P37231 2/20 0.48
MAPT P10636 2/20 0.48
SAE1 Q9UBE0 2/20 0.48
MEN1 O00255 1/20 0.48
NR1I2 O75469 1/20 0.48
LMNA P02545 1/20 0.48
CHRM2 P08172 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KMT2A Q03164 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL6013409 0.98 BID (0.50) BIDMCL1PPARABCL2L1BAK1
SCHEMBL7517986 0.98 BID (0.50) BIDMCL1PPARABCL2L1BAK1
Hydrochloric Acid SCHEMBL7557316 0.97 BID (0.49) BIDMCL1PPARABCL2L1BAK1
SCHEMBL486383 0.95 MEN1 (0.45) BIDMCL1PPARABCL2L1BAK1
SCHEMBL461600 0.88 PARP1 (0.41) MAPTMEN1NR1I2LMNACHRM2
SCHEMBL22736732 0.87 BID (0.48) BIDMCL1PPARABCL2L1BAK1
SCHEMBL28297464 0.86 MEN1 (0.38) MAPTMEN1NR1I2LMNACHRM2
SCHEMBL28850518 0.86 BID (0.50) BIDMCL1PPARABCL2L1BAK1
SCHEMBL28186455 0.86 BID (0.50) BIDMCL1PPARABCL2L1BAK1
SCHEMBL9342125 0.85 BID (0.56) BIDMCL1PPARABCL2L1BAK1

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
US-7126027-B2 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives AKZO NOBEL N.V. (NL) 2006-10-24 US disclosed