SCHEMBL9601158

SCHEMBL9601158

Cc1ccc2ncc3nc(CCCN)n(C)c3c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.41
MAPT P10636 1/20 0.41
PIK3CA P42336 5/20 0.38
MTOR P42345 4/20 0.38
PIK3CD O00329 3/20 0.37
TLR7 Q9NYK1 1/20 0.36
HTR1A P08908 2/20 0.35
ADRA1D P25100 2/20 0.35
ADRA1A P35348 2/20 0.35
ADRA1B P35368 2/20 0.35
PDPK1 O15530 2/20 0.35
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
LRRK2 Q5S007 3/20 0.34
PARP1 P09874 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
ADORA3 P0DMS8 1/20 0.34

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
Hydrochloric Acid SCHEMBL9603216 0.99 PDE10A (0.41) PDE10AMAPTPIK3CAMTORPIK3CD
Hydrochloric Acid SCHEMBL10427766 0.99 PDE10A (0.41) PDE10AMAPTPIK3CAMTORPIK3CD
SCHEMBL9602278 0.82 PIK3CA (0.40) PDE10APIK3CAMTORPIK3CDHTR1A
SCHEMBL10427746 0.81 SMN1; SMN2 (0.41) MAPTPDPK1JAK1
Hydrochloric Acid SCHEMBL9602926 0.80 PIK3CA (0.39) PDE10AMAPTPIK3CAMTORPIK3CD
SCHEMBL9602152 0.77 PIK3CA (0.56) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL1486592 0.75 TLR7 (0.44) PDE10APIK3CAMTORPIK3CDTLR7
SCHEMBL23935081 0.73 LRRK2 (0.47) LRRK2
SCHEMBL9602301 0.71 PIK3CA (0.42) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL30710541 0.71 TLR7 (0.60) PDE10ATLR7ADORA3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310950-B1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1993-01-13 EP disclosed
EP-0145340-B1 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1990-01-24 EP disclosed
EP-0310950-A1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1989-04-12 EP disclosed
US-4698348-A 1H-imidazo[4,5-c]quinolines and their use as bronchodilating agents RIKER LABORATORIES, INC. (US) 1987-10-06 US disclosed
EP-0145340-A2 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1985-06-19 EP disclosed