SCHEMBL8713441

SCHEMBL8713441

Cn1c(C(=O)Nc2ccc(OCC(=O)O)cc2)cc2ccc(C(=N)N)cc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
LMNA P02545 1/20 0.53
PLAU P00749 8/20 0.47
PLG P00747 6/20 0.47
KLKB1 P03952 5/20 0.47
PRSS1 P07477 5/20 0.47
F2 P00734 5/20 0.47
PLAT P00750 5/20 0.47
ITGB3 P05106 3/20 0.47
ITGA2B P08514 3/20 0.47
KLK1 P06870 1/20 0.46
MCL1 Q07820 2/20 0.46
ITGB1 P05556 1/20 0.45
ITGAV P06756 1/20 0.45
ITGB5 P18084 1/20 0.45
THRB P10828 1/20 0.45
F10 P00742 1/20 0.44

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
SCHEMBL8714127 0.88 MAPT (0.46) MAPTLMNAPLAUPLGKLKB1
SCHEMBL8716123 0.76 ITGB3 (0.55) MAPTPLAUPLGKLKB1PRSS1
SCHEMBL8714864 0.76 ITGB3 (0.55) PLAUPLGKLKB1PRSS1F2
SCHEMBL8715677 0.76 PLAU (0.48) PLAUPLGKLKB1PRSS1F2
SCHEMBL25015666 0.75 F10 (0.54) MAPTPLAUPLGKLKB1PRSS1
SCHEMBL8903362 0.75 MEN1 (0.48) PLAUPLGKLKB1PRSS1F2
SCHEMBL8717795 0.74 F2 (0.57) PLAUPLGKLKB1PRSS1F2
SCHEMBL7341713 0.74 PLAU (0.65) PLAUPLGKLKB1PRSS1F2
SCHEMBL8713016 0.73 F2 (0.57) PLAUPLGKLKB1PRSS1F2
SCHEMBL8903828 0.73 MEN1 (0.48) PLAUPLGKLKB1PRSS1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5753670-A ANTICOAGULANTS THE GREEN CROSS CORPORATION (JP) 1998-05-19 US disclosed
US-5635527-A ANTAGONIST OF PLATELET MEMBRANE GLYCOPROTEIN; TREATMENT OF THROMBOTIC DISEASES THE GREEN CROSS CORPORATION (JP) 1997-06-03 US disclosed
EP-0712844-A1 NOVEL FUSED-RING CARBOXYLIC ACID COMPOUND OR SALT THEREOF, AND MEDICINAL USE THEREOF THE GREEN CROSS CORPORATION (JP) 1996-05-22 EP disclosed