SCHEMBL2514925

SCHEMBL2514925

CC(C)(C)N(C[C@H]1COCc2nc3cnc4ccccc4c3n21)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 9/20 0.34
OPRM1 P35372 1/20 0.34
ABL1 P00519 4/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DUSP10 Q9Y6W6 1/20 0.31
TLR7 Q9NYK1 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL2517366 0.84 TLR7 (0.40) TLR7
SCHEMBL2515911 0.82 ABL1 (0.32) GRM5OPRM1ABL1TLR7
SCHEMBL1774432 0.80 ABL1 (0.37) GRM5OPRM1ABL1ALDH1A1TLR7
SCHEMBL2514656 0.80 ABL1 (0.35) GRM5ABL1LMNAMAPTALDH1A1
SCHEMBL2514657 0.79 HSD17B10 (0.33) MAPTALDH1A1
SCHEMBL2511908 0.77 GRM5 (0.35) GRM5ABL1
SCHEMBL1774978 0.76 TLR7 (0.34) GRM5OPRM1ALDH1A1TLR7
SCHEMBL9979366 0.76 CPB2 (0.40) TLR7
SCHEMBL2513228 0.76 CPB2 (0.40) TLR7
SCHEMBL1775336 0.75 GRM5 (0.41) GRM5OPRM1ABL1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034938-B2 Imidazo[4,5-c]quinolines, 6,7,8,9-tetrahydroimidazo[4,5-c]quinolines, imidazo[4,5-c]naphthyridines, and 6,7,8,9-tetrahydroimidazo[4,5-c]naphthyridines) with a CH( R1) group in the fused ring at 1-position of imidazo ring; modulate immune response, by induction of cytokine biosynthesis or other mechanism 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-10-11 US disclosed