SCHEMBL8905976

SCHEMBL8905976

CCOC(=O)CCN1CCC(NC(=O)c2occ3cc(C(=N)N)ccc23)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 4/20 0.45
PRSS1 P07477 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 0.45
PLG P00747 1/20 0.45
F2 P00734 3/20 0.45
F10 P00742 1/20 0.44
ITGB3 P05106 3/20 0.42
ITGA2B P08514 3/20 0.42
DRD4 P21917 5/20 0.38
TPSAB1 Q15661 1/20 0.37
TPSD1 Q9BZJ3 1/20 0.37
TPSG1 Q9NRR2 1/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL8904003 0.88 ITGB3 (0.48) ST14PRSS1PRSS2PRSS3F2
SCHEMBL8904382 0.86 ST14 (0.41) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8905208 0.85 ITGB3 (0.38) ST14PRSS1PRSS2PRSS3F2
SCHEMBL8715598 0.84 TPSAB1 (0.51) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8904600 0.83 ITGB3 (0.49) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8904747 0.78 ST14 (0.39) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8905129 0.77 ST14 (0.36) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8904820 0.76 ST14 (0.38) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8904683 0.76 ITGB3 (0.43) ST14PRSS1PRSS2PRSS3PLG
SCHEMBL8904684 0.75 ITGB3 (0.40) ST14PRSS1PRSS2PRSS3PLG

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