SCHEMBL7503802

SCHEMBL7503802

CCOC(=O)C1=Cc2cc(N(C)C)ccc2N=C(N)C1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 16/20 0.52
TLR7 Q9NYK1 8/20 0.52
PRKCI P41743 1/20 0.41
PRKCZ Q05513 1/20 0.41
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTPN1 P18031 1/20 0.38

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
SCHEMBL7509353 0.84 TLR8 (0.54) TLR8TLR7PRKCZALDH1A1MAPT
SCHEMBL10325225 0.83 TLR8 (0.53) TLR8TLR7ALDH1A1MAPT
SCHEMBL8188956 0.82 TLR8 (0.53) TLR8TLR7PRKCZALDH1A1LMNA
SCHEMBL10326208 0.81 TLR8 (0.55) TLR8TLR7
SCHEMBL10325490 0.81 TLR8 (0.59) TLR8TLR7
SCHEMBL10325903 0.81 TLR8 (0.58) TLR8TLR7LMNA
SCHEMBL10345313 0.81 TLR8 (0.67) TLR8TLR7ALDH1A1MAPTNPSR1
SCHEMBL7515216 0.81 TLR8 (0.70) TLR8TLR7ALDH1A1MAPK1NPSR1
SCHEMBL7505631 0.80 TLR8 (0.63) TLR8TLR7ALDH1A1LMNA
SCHEMBL10345314 0.80 TLR8 (0.57) TLR8TLR7ALDH1A1

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
EP-0825186-B1 2-Aminobenzazepine derivatives and their use for the treatment of immunosuppression PFIZER (US) 2002-04-17 EP disclosed
US-6043238-A 2-Aminobenzazapine derivatives PFIZER INC. (US) 2000-03-28 US disclosed