SCHEMBL8553714

SCHEMBL8553714

Cc1ccc(-c2nnc(N=C(N)N)c3c(C#N)cccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLAU P00749 4/20 0.37
PLG P00747 2/20 0.37
PLAT P00750 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDR P35968 1/20 0.36
HTT P42858 2/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 5/20 0.35
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL8552220 0.89 PLG (0.42) PLAUPLGPLATALDH1A1KDR
SCHEMBL8548363 0.81 PLAU (0.39) PLAUPLGPLATALDH1A1KDR
SCHEMBL8547668 0.79 PLAU (0.37) PLAUPLGPLATALDH1A1KDR
SCHEMBL8547926 0.78 ALDH1A1 (0.51) PLAUPLGPLATALDH1A1KDR
SCHEMBL8551333 0.77 ALDH1A1 (0.41) ALDH1A1HTTADORA2AADORA1SMN1; SMN2
SCHEMBL8552284 0.77 PLAU (0.40) PLAUPLGPLATALDH1A1KDR
SCHEMBL8553709 0.77 ALDH1A1 (0.43) ALDH1A1KDRHTTADORA2AADORA1
Hydrochloric Acid SCHEMBL8551926 0.72 PLAU (0.46) PLAUPLGPLATALDH1A1KDR
Hydrochloric Acid SCHEMBL8549377 0.69 PLG (0.55) PLAUPLGPLATALDH1A1KDR
SCHEMBL8374823 0.69 PLAU (0.47) PLAUPLGPLATALDH1A1KDR

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