SCHEMBL10587724

SCHEMBL10587724

CCCCCCCCNc1c([N+](=O)[O-])cnc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 2/20 0.51
S1PR2 O95136 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
DRD2 P14416 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
CHRM3 P20309 1/20 0.48
MAOA P21397 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
ADORA2A P29274 1/20 0.48
ADRA1A P35348 1/20 0.48
HRH1 P35367 1/20 0.48
DRD3 P35462 1/20 0.48
HTR2B P41595 1/20 0.48

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
SCHEMBL9602005 1.00 SMN1; SMN2 (0.51) SMN1; SMN2LMNAS1PR2NPSR1MAPK1
SCHEMBL8596001 0.99 SMN1; SMN2 (0.49) SMN1; SMN2LMNAS1PR2NPSR1MAPK1
SCHEMBL6718844 0.95 MAPT (0.50) SMN1; SMN2LMNAS1PR2NPSR1MAPK1
SCHEMBL6098673 0.94 MAPT (0.52) SMN1; SMN2LMNAMAPK1CHRM2CHRM1
SCHEMBL4314418 0.89 ADRA1A (0.49) SMN1; SMN2LMNAMAPK1CHRM2CHRM1
SCHEMBL5361174 0.89 ADRA1A (0.49) SMN1; SMN2LMNAMAPK1CHRM2CHRM1
SCHEMBL10735416 0.89 PRKCQ (0.46) SMN1; SMN2LMNAS1PR2NPSR1MAPK1
SCHEMBL4143499 0.88 MAPT (0.50) SMN1; SMN2LMNAMAPK1HTTCHRM2
SCHEMBL4316365 0.88 MAPT (0.50) SMN1; SMN2LMNAMAPK1HTTCHRM2
SCHEMBL4321129 0.88 ADRA1A (0.50) SMN1; SMN2LMNAMAPK1CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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