SCHEMBL7840128

SCHEMBL7840128

CC([O])C1CCCCNC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.41
CPB2 Q96IY4 1/20 0.41
SLC6A1 P30531 2/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 2/20 0.33
SLC6A11 P48066 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A13 Q9NSD5 1/20 0.33
CYP2D6 P10635 4/20 0.32
APLNR P35414 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.32
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 2/20 0.31
KCNH2 Q12809 2/20 0.31
BPTF Q12830 1/20 0.31
MEN1 O00255 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
SCHEMBL3470341 0.93
SCHEMBL197438 0.84
SCHEMBL14519154 0.82 CPN1 (0.39) CPN1CPB2SLC6A1TSHRLMNA
SCHEMBL25625516 0.80 CPN1 (0.38) CPN1CPB2SLC6A1TSHRLMNA
SCHEMBL7840129 0.78 CPN1 (0.41) CPN1CPB2SLC6A1TSHRLMNA
SCHEMBL7127999 0.77 CPN1 (0.43) CPN1CPB2SLC6A1TSHRLMNA
SCHEMBL5313699 0.76 CPN1 (0.51) CPN1CPB2SLC6A1TSHRLMNA
SCHEMBL21359336 0.76
SCHEMBL129252 0.75
SCHEMBL1109032 0.75

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-1102743-A1 AMIDE DERIVATIVES WHICH ARE USEFUL AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-05-30 EP claimed
WO-2000007980-A1 AMIDE DERIVATIVES WHICH ARE USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-02-17 WO claimed