SCHEMBL7345032

SCHEMBL7345032

N=C(N)c1ccc2cc(C(=O)Nc3cccc(CC4CCCC4)c3)ccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 19/20 1.00
▸ PLG P00747 11/20 0.66
▸ KLKB1 P03952 10/20 0.66
▸ PRSS1 P07477 10/20 0.66
▸ PLAT P00750 9/20 0.66
▸ F2 P00734 9/20 0.66
▸ KLK1 P06870 1/20 0.59
▸ ITGB3 P05106 1/20 0.52
▸ ITGA2B P08514 1/20 0.52

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
SCHEMBL7345040 0.83 PLAU (0.70) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL7336652 0.81 PLAU (0.70) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL7340950 0.79 PLAU (1.00) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL4324160 0.76 PLAU (1.00) PLAUPLGKLKB1PRSS1PLAT
Trifluoroacetic Acid SCHEMBL7358911 0.76 PLAU (0.62) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL7344349 0.75 PLAU (0.74) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL9305779 0.74 PLAU (0.71) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL4330440 0.74 PLAU (1.00) PLAUPLGKLKB1PRSS1PLAT
Trifluoroacetic Acid SCHEMBL7856136 0.74 PLAU (0.86) PLAUPLGKLKB1PRSS1PLAT
SCHEMBL7335930 0.73 PLAU (0.78) PLAUPLGKLKB1PRSS1PLAT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

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