SCHEMBL11468266

SCHEMBL11468266

CCCOc1nnc(-c2ccc(N(C)C)cc2)c(-c2ccc(N(C)C)cc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
ADK P55263 3/20 0.36
HSD17B10 Q99714 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 2/20 0.36
TSHR P16473 1/20 0.36
MCL1 Q07820 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
THRB P10828 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NOX1 Q9Y5S8 1/20 0.35
SYK P43405 1/20 0.34
HPGD P15428 1/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
GAA P10253 1/20 0.34
APP P05067 4/20 0.34

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
SCHEMBL11470140 0.93 TLR7 (0.43) MAPTADKHSD17B10KDM4EALDH1A1
SCHEMBL11244627 0.88 ADK (0.38) MAPTADKHSD17B10KDM4EALDH1A1
SCHEMBL11467948 0.87 PTGES (0.35) MAPTHSD17B10KDM4EALDH1A1RAB9A
SCHEMBL11483171 0.83 RAB9A (0.49) MAPTHSD17B10KDM4EALDH1A1RAB9A
SCHEMBL11485177 0.82 ADK (0.37) ADKTLR7NOX1SYKTP53
SCHEMBL11470726 0.81 TP53 (0.50) MAPTHSD17B10KDM4EALDH1A1RAB9A
SCHEMBL11485833 0.81 PTGES (0.51) MAPTHSD17B10KDM4EALDH1A1RAB9A
SCHEMBL11485810 0.80 MAPT (0.45) MAPTADKHSD17B10KDM4EALDH1A1
SCHEMBL11469809 0.79 CNR1 (0.47) MAPTADKHSD17B10KDM4EALDH1A1
SCHEMBL11469647 0.79 PTGES (0.39) MAPTHSD17B10KDM4EALDH1A1RAB9A

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
US-4190725-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1980-02-26 US disclosed
US-4021553-A 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-05-03 US disclosed