SCHEMBL7009761

SCHEMBL7009761

CCC(=Nc1ccc(CN2CCN(S(=O)(=O)c3cc4ccc(Cl)cc4s3)CC2=O)cc1)N1CCC(C(=O)O)CC1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 2/20 0.48

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
SCHEMBL6699960 0.84 F10 (0.61) F10F2
SCHEMBL6699958 0.84 F10 (0.82) F10F2
SCHEMBL7006201 0.83 F10 (0.59) F10
SCHEMBL1653109 0.80 F10 (0.80) F10F2
SCHEMBL6692678 0.79 F10 (0.56) F10F2
SCHEMBL6692676 0.79 F10 (0.56) F10F2
SCHEMBL7009756 0.79 F10 (0.74) F10
SCHEMBL1654478 0.78 F10 (0.75) F10F2
SCHEMBL1651558 0.75 F10 (0.73) F10F2
SCHEMBL4388192 0.75 F10 (0.71) F10

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
EP-1322643-A1 PIPERAZIN-2-ONE AMIDES AS INHIBITORS OF FACTOR XA Millennium Pharmaceuticals, Inc. (US) 2003-07-02 EP disclosed
WO-2002026734-A1 PIPERAZIN-2-ONE AMIDES AS INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2002-04-04 WO disclosed