SCHEMBL7483353

SCHEMBL7483353

CCOC1OC(=O)CC1N(CCn1ccc2ccccc21)C(=O)C(CC(N)=O)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
MAPK1 P28482 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
CASP1 P29466 1/20 0.34
MTNR1A P48039 2/20 0.32
MTNR1B P49286 2/20 0.32
TSHR P16473 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HSD17B10 Q99714 2/20 0.31
TP53 P04637 1/20 0.31
HTT P42858 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7482492 0.79 CASP3 (0.32) CASP1ALDH1A1
SCHEMBL6161964 0.72 CASP1 (0.54) LMNAMAPK1CYP1A2CYP3A4CYP2C19
SCHEMBL7483357 0.70 MAPK1 (0.45) LMNAMAPK1CYP1A2CYP3A4CYP2C19
SCHEMBL9701812 0.59 LMNA (0.63) LMNAHTR2AHTR2CMAPK1CYP1A2
SCHEMBL7349228 0.58 LMNA (1.00) LMNAHTR2AHTR2CMAPK1CYP1A2
SCHEMBL6160192 0.57 CASP3 (0.33) CASP1
SCHEMBL1520197 0.57 HTR2A (0.62) LMNAHTR2AHTR2CMAPK1CYP1A2
SCHEMBL9324289 0.56 LMNA (0.61) LMNAHTR2AHTR2CMAPK1CYP1A2
SCHEMBL2036331 0.56 HTR2A (0.70) LMNAHTR2AHTR2CMAPK1CYP1A2
SCHEMBL299494 0.56 LMNA (0.50) LMNAHTR2AHTR2CMAPK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082127-A4 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER LAMBERT CO (US) 2002-10-09 EP claimed
EP-1082127-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 2001-03-14 EP claimed
WO-1999056765-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-11-11 WO claimed
EP-1082127-A4 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER LAMBERT CO (US) 2002-10-09 EP disclosed
EP-1082127-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 2001-03-14 EP disclosed
WO-1999056765-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-11-11 WO disclosed