SCHEMBL2371342

SCHEMBL2371342

COc1c2ccccc2nn1CC(C)O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MPO P05164 14/20 0.60
ATM Q13315 1/20 0.48
PTGER4 P35408 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
SLC2A1 P11166 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
SCHEMBL204878 0.80 MCL1 (0.39) MPO
SCHEMBL205462 0.76 MPO (0.60) MPOATMPTGER4
SCHEMBL18073164 0.76 MPO (0.91) MPOATM
SCHEMBL13030180 0.74 MPO (0.65) MPOATMPTGER4
SCHEMBL20132949 0.70 MPO (0.61) MPOATM
SCHEMBL202865 0.68 MPO (0.57) MPOATM
SCHEMBL15881958 0.66 ELANE (0.54) PTGER4
SCHEMBL11442537 0.65 APAF1 (0.68)
SCHEMBL15882075 0.63 TSHR (0.51) PTGER4
SCHEMBL17324748 0.63 HTR3A (0.45)

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-2364301-A1 ENANTIOMERICALLY ENRICHED ARYLOAZOL- 2 -YL CYANOETHYLAMINO PARACITICIDAL COMPOUNDS Merial Limited (US) 2011-09-14 EP disclosed
WO-2010056999-A1 ENANTIOMERICALLY ENRICHED ARYLOAZOL- 2 -YL CYANOETHYLAMINO PARACITICIDAL COMPOUNDS MERIAL LIMITED (US) 2010-05-20 WO disclosed