SCHEMBL8906283

SCHEMBL8906283

Cc1oc(C(=O)NC2CCC(OCC(=O)OC(C)(C)C)CC2)c2ccc(C(=N)N)cc12

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 3/20 0.40
ITGA2B P08514 3/20 0.40
ST14 Q9Y5Y6 12/20 0.37
F2 P00734 11/20 0.37
PRSS1 P07477 11/20 0.37
PRSS2 P07478 9/20 0.37
PRSS3 P35030 9/20 0.37
PLG P00747 3/20 0.37
TPSAB1 Q15661 1/20 0.35
TPSD1 Q9BZJ3 1/20 0.35
TPSG1 Q9NRR2 1/20 0.35
F10 P00742 1/20 0.34
HPGDS O60760 2/20 0.34
TMPRSS15 P98073 2/20 0.33

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
SCHEMBL8904093 0.90 ITGB3 (0.37) ITGB3ITGA2BST14F2PRSS1
SCHEMBL8904049 0.88 ITGB3 (0.45) ITGB3ITGA2BST14F2PRSS1
SCHEMBL8906270 0.87 NPC1 (0.46) ITGB3ITGA2B
SCHEMBL8715011 0.87 NPC1 (0.46) ITGB3ITGA2B
SCHEMBL8903365 0.84 ITGB3 (0.38) ITGB3ITGA2BST14F2PRSS1
SCHEMBL8904086 0.84 NPC1 (0.39) ITGB3ITGA2BST14F2PRSS1
SCHEMBL8716092 0.84 NPC1 (0.39) ITGB3ITGA2BST14F2PRSS1
SCHEMBL8903418 0.83 DRD2 (0.38)
SCHEMBL8903361 0.81 F2 (0.51) ITGB3ITGA2BF2TPSAB1TPSD1
SCHEMBL8712867 0.81 F2 (0.51) ITGB3ITGA2BF2TPSAB1TPSD1

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-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