SCHEMBL8717795

SCHEMBL8717795

N=C(N)c1ccc2oc(C(=O)Nc3ccc(OCC(=O)O)cc3)cc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.57
TPSAB1 Q15661 5/20 0.57
TPSD1 Q9BZJ3 5/20 0.57
TPSG1 Q9NRR2 5/20 0.57
ITGB3 P05106 5/20 0.54
ITGA2B P08514 5/20 0.54
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
KMT2A Q03164 1/20 0.53
PLG P00747 5/20 0.51
PLAU P00749 5/20 0.51
KLKB1 P03952 5/20 0.51
PRSS1 P07477 5/20 0.51
PLAT P00750 4/20 0.51
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
KLK1 P06870 1/20 0.49
ITGB1 P05556 1/20 0.47

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
SCHEMBL8716123 0.92 ITGB3 (0.55) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8713417 0.88 KMT2A (0.48) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8904649 0.88 ITGB3 (0.53) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8718100 0.87 TPSAB1 (0.66) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8718615 0.86 TPSAB1 (0.52) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8718459 0.86 ITGB3 (0.57) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8718388 0.85 ALDH1A1 (0.48) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8715779 0.85 F2 (0.52) F2TPSAB1TPSD1TPSG1ITGB3
SCHEMBL8904666 0.83 ITGB3 (0.62) F2ITGB3ITGA2BPLGPLAU
SCHEMBL8718457 0.82 PLG (0.55) F2TPSAB1TPSD1TPSG1ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5635527-A ANTAGONIST OF PLATELET MEMBRANE GLYCOPROTEIN; TREATMENT OF THROMBOTIC DISEASES THE GREEN CROSS CORPORATION (JP) 1997-06-03 US claimed
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 claimed
JP-8053398-A None JP disclosed
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
JP-H0853398-A NEW CONDENSED RING CARBOXYLIC ACID DERIVATIVE OR ITS SALT AND MEDICINAL USE THEREOF GREEN CROSS CORP:THE 1996-02-27 JP disclosed