SCHEMBL8551840

SCHEMBL8551840

CSc1cccc2c(-c3ccccc3)nnc(N=C(N)N)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 3/20 0.42
ALDH1A1 P00352 4/20 0.41
RAD52 P43351 4/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
PLAU P00749 7/20 0.38
NPSR1 Q6W5P4 2/20 0.36
POLB P06746 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 2/20 0.34
HTT P42858 1/20 0.34
MPO P05164 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33

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 SCHEMBL8552865 0.99 PLG (0.41) PLGALDH1A1RAD52MAPTKMT2A
SCHEMBL8374823 0.80 PLAU (0.47) PLGALDH1A1RAD52MAPTKMT2A
Hydrochloric Acid SCHEMBL8549377 0.80 PLG (0.55) PLGALDH1A1RAD52MAPTKMT2A
SCHEMBL8518199 0.80 PLG (0.45) PLGALDH1A1RAD52MAPTKMT2A
Hydrochloric Acid SCHEMBL8547928 0.79 PLG (0.44) PLGALDH1A1RAD52MAPTKMT2A
Hydrochloric Acid SCHEMBL8548609 0.79 PLAU (0.44) PLGALDH1A1RAD52MAPTKMT2A
Hydrochloric Acid SCHEMBL8547382 0.79 PLAU (0.46) PLGALDH1A1RAD52MAPTKMT2A
SCHEMBL8551490 0.78 PLG (0.40) PLGALDH1A1RAD52MAPTKMT2A
SCHEMBL8547610 0.78 PLG (0.40) PLGALDH1A1RAD52MAPTKMT2A
SCHEMBL8551931 0.77 PLG (0.53) PLGALDH1A1RAD52MAPTKMT2A

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-0825187-A1 Condensed pyridazinyl guanidines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-25 EP disclosed