SCHEMBL7345139

SCHEMBL7345139

NCc1ccc(NC(=O)c2cc(Nc3ncccn3)c3cc(C(N)=NO)ccc3c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLAU P00749 13/20 1.00
PLG P00747 13/20 0.80
KLK1 P06870 11/20 0.80
PLAT P00750 8/20 0.80
PRSS1 P07477 5/20 0.80
F2 P00734 4/20 0.80
KLKB1 P03952 2/20 0.47
KIT P10721 1/20 0.44
PDGFRA P16234 1/20 0.44
TNIK Q9UKE5 1/20 0.39
KLK6 Q92876 4/20 0.39
NPC1 O15118 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
GFER P55789 1/20 0.39

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
SCHEMBL7339552 0.89 PLAU (0.81) PLAUPLGKLK1PLATPRSS1
SCHEMBL7341506 0.89 PLAU (0.81) PLAUPLGKLK1PLATPRSS1
SCHEMBL4320529 0.89 PLAU (1.00) PLAUPLGKLK1PLATPRSS1
Trifluoroacetic Acid SCHEMBL7336462 0.84 PLAU (0.90) PLAUPLGKLK1PLATPRSS1
SCHEMBL6433868 0.83 PLAU (0.70) PLAUPLGKLK1PLATPRSS1
SCHEMBL6439559 0.81 PLAU (0.86) PLAUPLGKLK1PLATPRSS1
SCHEMBL7358945 0.80 PLAU (0.67) PLAUPLGKLK1PLATPRSS1
SCHEMBL7358951 0.80 PLAU (0.67) PLAUPLGKLK1PLATPRSS1
SCHEMBL6436054 0.77 PLAU (1.00) PLAUPLGKLK1PLATPRSS1
SCHEMBL6439587 0.75 PLAU (0.60) PLAUPLGKLK1PLATPRSS1

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
US-6284796-B1 NAPHTHAMIDINE COMPOUNDS ABBOTT LABORATORIES 2001-09-04 US disclosed