SCHEMBL2362286

SCHEMBL2362286

Cc1ccc2nc(N)n(CCN3CCOCC3)c2c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.60
LMNA P02545 2/20 0.53
MAPT P10636 2/20 0.53
TSHR P16473 2/20 0.53
CREBBP Q92793 1/20 0.53
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 2/20 0.44
POLB P06746 2/20 0.44
MAPK1 P28482 1/20 0.44
GAA P10253 1/20 0.43
ACHE P22303 2/20 0.43
APP P05067 1/20 0.43
BCHE P06276 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KCNH2 Q12809 1/20 0.41

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
SCHEMBL14247511 0.84 ALOX15 (0.53) TLR8LMNAMAPTTSHRCREBBP
SCHEMBL2365475 0.82 LMNA (0.48) LMNAMAPTTSHRCREBBPKMT2A
SCHEMBL15337717 0.81 LMNA (0.47) TLR8LMNAMAPTTSHRCREBBP
SCHEMBL3599686 0.81 LMNA (0.68) TLR8LMNAMAPTTSHRALDH1A1
SCHEMBL18731439 0.81 LMNA (0.61) TLR8LMNAMAPTTSHRCREBBP
SCHEMBL14247207 0.79 ALOX15 (0.47) TLR8LMNATSHRKMT2AMEN1
SCHEMBL23638275 0.76 RAB9A (0.58) LMNAMAPTTSHRCREBBPKMT2A
SCHEMBL2335115 0.76 TLR8 (0.91) TLR8POLB
SCHEMBL18731438 0.75 LMNA (0.53) TLR8LMNAMAPTTSHRCREBBP
SCHEMBL16512956 0.75 TLR8 (1.00) TLR8POLB

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
WO-2011099832-A2 NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CRYSTALGENOMICS, INC. (KR) 2011-08-18 WO disclosed