SCHEMBL8818181

SCHEMBL8818181

CCN(CC)CCNc1ccc(N=Nc2ccccc2)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.59
▸ CHEK1 O14757 1/20 0.59
▸ PIM1 P11309 1/20 0.59
▸ LTK P29376 1/20 0.59
▸ LIMK1 P53667 1/20 0.59
▸ CLK4 Q9HAZ1 1/20 0.59
▸ MAPT P10636 4/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CHRM2 P08172 2/20 0.41
▸ HTR1A P08908 2/20 0.41
▸ ADRA2A P08913 2/20 0.41
▸ CHRM1 P11229 2/20 0.41
▸ TBXA2R P21731 2/20 0.41
▸ SLC6A2 P23975 2/20 0.41
▸ APEX1 P27695 2/20 0.41

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
SCHEMBL8818171 1.00 IDO1 (0.59) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8814720 0.91 IDO1 (0.59) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8818168 0.90 IDO1 (0.54) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8818174 0.90 IDO1 (0.54) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8818156 0.87 IDO1 (0.51) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8818163 0.87 IDO1 (0.51) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8818039 0.86 CHEK1 (0.50) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8814722 0.86 IDO1 (0.50) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8817990 0.86 CHEK1 (0.47) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL8817997 0.86 CHEK1 (0.47) IDO1CHEK1PIM1LTKLIMK1

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
WO-1997016194-A1 NAPHTHYLAZO INHIBITION OF AMYLOIDOSIS WARNER-LAMBERT COMPANY (US) 1997-05-09 — — WO claimed
Send feedback