SCHEMBL23775855

SCHEMBL23775855

N=C(N)c1ccc2[nH]c(-c3ccc4c(=O)c5ccc(-c6nc7cc(C(=N)N)ccc7[nH]6)cc5oc4c3)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLAU P00749 6/20 0.47
PRSS1 P07477 2/20 0.47
CHEK2 O96017 1/20 0.46
F2 P00734 2/20 0.45
F10 P00742 2/20 0.45
F7 P08709 1/20 0.45
PLG P00747 5/20 0.44
PLAT P00750 1/20 0.40
HCRTR1 O43613 1/20 0.40

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
SCHEMBL23775849 0.87 PLAU (0.50) PLAUPRSS1F2F10F7
SCHEMBL23775851 0.84 PLAU (0.47) PLAUPRSS1F2F10F7
SCHEMBL14599569 0.84 PLAU (0.51) PLAUPRSS1CHEK2F2F10
SCHEMBL23775610 0.81 F2 (0.50) PLAUPRSS1F2F10F7
SCHEMBL23775790 0.81 PLAU (0.51) PLAUPRSS1F2F10F7
SCHEMBL23775814 0.81 PLAU (0.48) PLAUPRSS1F2F10F7
Hydrochloric Acid SCHEMBL11298806 0.80 PLAU (0.65) PLAUPRSS1F2F10F7
SCHEMBL7879342 0.80 PLAU (0.65) PLAUPRSS1F2F10F7
SCHEMBL12348331 0.78 CHEK2 (0.42) PLAUPRSS1CHEK2
SCHEMBL12348336 0.78 PLAU (0.48) PLAUPRSS1F2F10F7

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-2021160132-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海美悦生物科技发展有限公司 2021-08-19 WO disclosed