SCHEMBL6947872

SCHEMBL6947872

CNCCC1=CCN(C)CC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.36
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
PRMT8 Q9NR22 1/20 0.32

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
SCHEMBL9644027 0.79 QDPR (0.39) QDPR
SCHEMBL13783321 0.77 QDPR (0.42) QDPR
SCHEMBL13599361 0.76 QDPR (0.37) QDPR
SCHEMBL9127424 0.74 QDPR (0.36) QDPR
SCHEMBL9130285 0.74 QDPR (0.36) QDPR
SCHEMBL10752307 0.74 QDPR (0.36) QDPR
SCHEMBL3424079 0.74 QDPR (0.40) QDPR
SCHEMBL7607024 0.74
SCHEMBL19033786 0.73 CARM1 (0.35) CARM1PRMT6
SCHEMBL4700734 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0674623-B1 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2003-04-09 EP disclosed
US-6403578-B1 ANTICOAGULANTS, CARDIOVASCULAR DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-06-11 US disclosed
EP-0674623-A1 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1995-10-04 EP disclosed
WO-1994014776-A2 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1994-07-07 WO disclosed