SCHEMBL7101360

SCHEMBL7101360

COP(=O)(CCn1c(=O)[nH]c2ncn(C)c2c1=O)OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 3/20 0.54
CYP3A4 P08684 3/20 0.54
PMP22 Q01453 3/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
TSHR P16473 1/20 0.54
GDA Q9Y2T3 1/20 0.41
PDE4A P27815 5/20 0.39
ADORA2A P29274 5/20 0.39
PDE4B Q07343 5/20 0.39
PDE4C Q08493 5/20 0.39
PDE4D Q08499 5/20 0.39
ADORA2B P29275 5/20 0.39
TRPA1 O75762 1/20 0.37
ADORA3 P0DMS8 2/20 0.36
CYP1A2 P05177 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GLA P06280 1/20 0.35
CNOT7 Q9UIV1 1/20 0.35

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
SCHEMBL7096838 0.80 PDE4A (0.65) BLMCYP3A4PMP22ALDH1A1GDA
SCHEMBL8355196 0.79 CYP3A4 (0.64) BLMCYP3A4PMP22ALDH1A1LMNA
SCHEMBL26925735 0.78 CYP3A4 (0.66) BLMCYP3A4PMP22ALDH1A1LMNA
SCHEMBL11442354 0.74 BLM (0.54) BLMCYP3A4PMP22ALDH1A1LMNA
SCHEMBL7100345 0.73 ADORA2B (0.50) BLMCYP3A4PMP22LMNATSHR
SCHEMBL7403404 0.72 ALDH1A1 (0.57) BLMCYP3A4PMP22ALDH1A1LMNA
SCHEMBL8061720 0.72 LMNA (0.54) BLMCYP3A4PMP22ALDH1A1LMNA
SCHEMBL31065362 0.71 CYP3A4 (0.52) BLMCYP3A4PMP22ALDH1A1LMNA
SCHEMBL7099928 0.71 ADORA2B (0.50) BLMCYP3A4PMP22PDE4AADORA2A
SCHEMBL6344281 0.71 LMNA (0.52) BLMCYP3A4PMP22ALDH1A1LMNA

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-1140952-B1 ORGANO-PHOSPHORUS COMPOUNDS AND THEIR UTILIZATION BIOAGENCY AG (DE) 2003-09-03 EP disclosed
EP-1140952-A1 ORGANO-PHOSPHORUS COMPOUNDS AND THEIR UTILIZATION Jomaa Pharmaka GmbH (DE) 2001-10-10 EP disclosed
WO-2000037477-A1 ORGANO-PHOSPHORUS COMPOUNDS AND THEIR UTILIZATION JOMAA PHARMAKA GMBH (DE) 2000-06-29 WO disclosed