SCHEMBL8556028

SCHEMBL8556028

CC(C)(C)OC(=O)COc1cccc(C(=O)CNC(=O)c2cc3c(s2)CCN(C(=O)OC(C)(C)C)C3)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 7/20 0.43
WDR77 Q9BQA1 7/20 0.43
ITGB3 P05106 6/20 0.43
ITGA2B P08514 6/20 0.43
HDAC6 Q9UBN7 2/20 0.42
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
F2 P00734 1/20 0.38
TPSAB1 Q15661 1/20 0.38
TPSD1 Q9BZJ3 1/20 0.38
TPSG1 Q9NRR2 1/20 0.38
ACKR3 P25106 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38

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
SCHEMBL8558884 0.91 ITGB3 (0.53) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8556843 0.87 ITGB3 (0.48) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8832697 0.86 ITGB3 (0.50) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8455279 0.85 ITGB3 (0.60) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8555620 0.85 ITGB3 (0.55) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8557314 0.84 ITGB3 (0.51) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8556021 0.83 F2 (0.41) PRMT5WDR77HDAC6BRD4CREBBP
SCHEMBL8558319 0.83 ITGB3 (0.48) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8553064 0.82 ITGB3 (0.62) PRMT5WDR77ITGB3ITGA2BHDAC6
SCHEMBL8832972 0.82 ITGB3 (0.47) PRMT5WDR77ITGB3ITGA2BHDAC6

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
EP-0641770-B1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA CO (JP) 1998-05-13 EP disclosed
US-5594004-A CARDIOVASCULAR DISORDERS AND ANTICOAGULANTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-01-14 US disclosed
EP-0641770-A1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-03-08 EP disclosed