SCHEMBL9602829

SCHEMBL9602829

CN(C)CCn1cnc2cnc3ccccc3c21

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 2/20 0.44
TOP2A P11388 1/20 0.41
MTOR P42345 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 1/20 0.39
ALPG P10696 1/20 0.39
TLR7 Q9NYK1 1/20 0.38
HTR6 P50406 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
EGFR P00533 2/20 0.36

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 SCHEMBL9603162 0.97 PDPK1 (0.43) PDPK1TOP2AMTORTDP1GAA
SCHEMBL6838085 0.87 TLR7 (0.51) TOP2ATDP1GAATLR7SMN1; SMN2
SCHEMBL12183166 0.81 PDPK1 (0.44) PDPK1MTORHTR6PDE4APDE4B
SCHEMBL2029970 0.81 PDE4A (0.47) TDP1TLR7SMN1; SMN2PDE4APDE4B
SCHEMBL667481 0.81 DPP4 (0.43) PDPK1TDP1TLR7SMN1; SMN2
SCHEMBL9601955 0.80 SMN1; SMN2 (0.42) TDP1TLR7SMN1; SMN2HTR2APDE4A
Water SCHEMBL22718534 0.79 DPP4 (0.45) PDPK1TDP1TLR7SMN1; SMN2
Water SCHEMBL29438456 0.79 DPP4 (0.45) PDPK1TDP1TLR7SMN1; SMN2
SCHEMBL29723995 0.79 SMN1; SMN2 (0.56) SMN1; SMN2
SCHEMBL15924453 0.79 TLR7 (0.47) TLR7SMN1; SMN2PDE4APDE4BPDE4C

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