SCHEMBL11434898

SCHEMBL11434898

Cn1c(-c2ccc(Cl)cc2)nc2c3ccccc3ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.49
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 4/20 0.40
HCRTR1 O43613 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 2/20 0.40
PKM P14618 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TLR8 Q9NR97 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL11184964 0.88 TLR7 (0.51) TLR7MEN1KMT2AMAPTKDM4E
SCHEMBL9611690 0.88 TLR7 (0.61) TLR7MEN1KMT2ANR1H2NR1H3
SCHEMBL11287517 0.86 HDAC3 (0.47) TLR7MAPTKDM4ENPC1RAB9A
SCHEMBL11448854 0.85 TLR7 (0.49) TLR7MEN1KMT2AMAPTKDM4E
SCHEMBL16692216 0.85 TLR7 (0.49) TLR7MEN1KMT2AMAPTKDM4E
SCHEMBL11184987 0.85 NPC1 (0.57) TLR7MEN1KMT2AMAPTKDM4E
SCHEMBL11099196 0.85 TLR7 (0.49) TLR7MEN1KMT2AMAPTKDM4E
SCHEMBL11449199 0.85 TLR7 (0.46) TLR7MEN1KMT2AMAPTL3MBTL1
SCHEMBL16692201 0.84 TLR7 (0.48) TLR7MEN1KMT2AMAPTL3MBTL1
SCHEMBL11079289 0.84 TLR7 (0.51) TLR7NR1H2NR1H3MAPTL3MBTL1

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
EP-0012866-A1 New 3H-naphtho(1,2-d)imidazoles, processes for preparing them, compounds for use as antiinflammatory and antimicrobial agents and compositions for that use containing them GRUPPO LEPETIT S.P.A. (IT) 1980-07-09 EP disclosed