SCHEMBL8727256

SCHEMBL8727256

CCC(C)c1cccc2nc(N)c3nc[nH]c3c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 6/20 0.40
TLR7 Q9NYK1 4/20 0.40
ABL1 P00519 1/20 0.34
RAD52 P43351 1/20 0.34
RIN1 Q13671 1/20 0.34
CDK1 P06493 2/20 0.34
CCNB1 P14635 2/20 0.34
CCNA2 P20248 2/20 0.34
CDK2 P24941 2/20 0.34
CCNA1 P78396 2/20 0.34
PIK3CD O00329 2/20 0.33
PIK3R1 P27986 2/20 0.33
PIK3CA P42336 2/20 0.33
PIK3CB P42338 2/20 0.33
PIK3CG P48736 2/20 0.33
ELANE P08246 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
HRH2 P25021 1/20 0.33
ADRA1D P25100 1/20 0.33

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
SCHEMBL8727251 0.87 ELANE (0.39) TLR8TLR7ABL1RAD52RIN1
SCHEMBL6705148 0.80 TLR8 (0.34) TLR8TLR7PIK3CDPIK3R1PIK3CA
SCHEMBL25958200 0.79 ELANE (0.46) TLR8TLR7ABL1RAD52RIN1
SCHEMBL1692289 0.79 TLR7 (0.39) TLR8TLR7ABL1RAD52RIN1
SCHEMBL5139045 0.78 ABL1 (0.32) ABL1RAD52RIN1
SCHEMBL8571306 0.77 PARP1 (0.46) ABL1RAD52RIN1PIK3CDPIK3CG
SCHEMBL8575636 0.77 TLR8 (0.35) TLR8TLR7ABL1RAD52RIN1
SCHEMBL17956087 0.77 TLR8 (0.31) TLR8CDK1CCNB1CCNA2CDK2
SCHEMBL30612922 0.77 TLR8 (0.49) TLR8TLR7ABL1RAD52RIN1
SCHEMBL5139744 0.77 ABL1 (0.31) ABL1RAD52RIN1

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-5756747-A 1H-imidazo 4,5-c!quinolin-4-amines RIKER LABORATORIES, INC. (US) 1998-05-26 US disclosed
EP-0385630-A2 1H-imidazo(4,5-c)Quinolin-4-amines as antivirals RIKER LABORATORIES, INC. (US) 1990-09-05 EP disclosed