SCHEMBL11401736

SCHEMBL11401736

N#CCCNc1cccc2c(O)cccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 9/20 0.50
CHEK1 O14757 1/20 0.44
PIM1 P11309 1/20 0.44
LTK P29376 1/20 0.44
LIMK1 P53667 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
GAA P10253 5/20 0.40
ALDH1A1 P00352 3/20 0.40
CDC25B P30305 3/20 0.40
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA12 O43570 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38

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
SCHEMBL10498975 0.82 MAPT (0.46) IDO1GAAALDH1A1HTTKDM4E
SCHEMBL11531836 0.82 IDO1 (0.46) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL7250746 0.79 CA12 (0.61) GAAALDH1A1CDC25BKDM4EMAPT
SCHEMBL11811252 0.79 IDO1 (0.56) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL11400923 0.77 IDO1 (0.80) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL11401614 0.77 IDO1 (0.54) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL11248471 0.76 GAA (0.46) GAAALDH1A1HTTKDM4EMAPT
SCHEMBL11403032 0.75 IDO1 (0.65) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL11400602 0.75 IDO1 (0.55) IDO1CHEK1PIM1LTKLIMK1
SCHEMBL11405717 0.73 IDO1 (0.57) 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
EP-0030314-A1 Water-insoluble monoazo dyestuffs, their preparation and use in dyeing and printing synthetic polymeric materials AZIENDE COLORI NAZIONALI AFFINI ACNA S.P.A. (IT) 1981-06-17 EP disclosed