SCHEMBL8179545

SCHEMBL8179545

CCOC(=O)C1=Cc2ccc(OC)cc2N=C(N)C1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 18/20 0.60
TLR7 Q9NYK1 8/20 0.60
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL8188956 0.91 TLR8 (0.53) TLR8TLR7CA12CA9KDM4E
SCHEMBL7508446 0.85 TLR8 (0.62) TLR8TLR7
SCHEMBL12701620 0.85 TLR8 (0.57) TLR8TLR7
SCHEMBL3032882 0.84 TLR8 (0.61) TLR8TLR7
SCHEMBL10326201 0.84 TLR8 (0.56) TLR8TLR7KDM4EALDH1A1HPGD
SCHEMBL7505631 0.84 TLR8 (0.63) TLR8TLR7ALDH1A1
SCHEMBL8191084 0.83 TLR8 (0.60) TLR8TLR7
SCHEMBL22771214 0.83 TLR8 (0.60) TLR8TLR7
SCHEMBL8179986 0.83 TLR8 (0.54) TLR8TLR7KDM4EALDH1A1HPGD
SCHEMBL8196330 0.83 TLR8 (0.70) TLR8TLR7

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-6043238-A 2-Aminobenzazapine derivatives PFIZER INC. (US) 2000-03-28 US disclosed
EP-0825186-A1 2-Aminobenzazepine derivatives and their use for the treatment of immunosuppression PFIZER INC. (US) 1998-02-25 EP disclosed