SCHEMBL27466565

SCHEMBL27466565

CCC[CH]C1CCCCN1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.38
SLC6A4 P31645 12/20 0.38
SLC6A3 Q01959 12/20 0.38
CYP2D6 P10635 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
MLNR O43193 1/20 0.34
ABCB11 O95342 1/20 0.34
EGFR P00533 1/20 0.34
FYN P06241 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
HTR1A P08908 1/20 0.34
CHRM5 P08912 1/20 0.34
ADRA2A P08913 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
SCHEMBL2090139 0.88 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3CYP1A2
SCHEMBL3817537 0.84
SCHEMBL27876252 0.83 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3CYP2D6MEN1
SCHEMBL20537294 0.82 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3CYP2D6MEN1
SCHEMBL3390986 0.80 PRCP (0.41) SLC6A2SLC6A4SLC6A3TSHR
SCHEMBL447293 0.77
SCHEMBL18735782 0.75 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3CYP2D6MEN1
SCHEMBL14032382 0.72 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL1515328 0.72
SCHEMBL14782700 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1252065-C Cinnoline compounds ASTRAZENECA AB (SE) 2006-04-19 CN disclosed
CN-1245402-C indole derivatives, process for their preparation, pharmaceutical compositions containing them and their use ASTRAZENECA AB (SE) 2006-03-15 CN disclosed
CN-1167422-C Quinazoline derivatives as angiogenesis inhibitors 2004-09-22 CN disclosed
CN-1468230-A Compound (I) 2004-01-14 CN disclosed
CN-1446214-A Cinnoline compounds ASTRAZENECA AB (SE) 2003-10-01 CN disclosed
CN-1346271-A Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA UK LTD (SE) 2002-04-24 CN disclosed