SCHEMBL5320853

SCHEMBL5320853

NCCn1nc(-c2ccc(CN3CCN(S(=O)(=O)c4cc5cc(Cl)ccc5[nH]4)CC3=O)cc2)ccc1=O

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.65
KLK1 P06870 1/20 0.40
F2 P00734 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL5324898 0.90 F10 (0.66) F10KLK1KCNH2
SCHEMBL5324672 0.90 F10 (0.64) F10KLK1F2KCNH2
Hydrochloric Acid SCHEMBL5322543 0.90 F10 (0.63) F10KLK1F2KCNH2
SCHEMBL5090987 0.90 F10 (0.61) F10KLK1F2KCNH2
SCHEMBL5329273 0.84 F10 (0.57) F10KLK1KCNH2
SCHEMBL5326100 0.84 F10 (0.58) F10KLK1KCNH2
SCHEMBL5328255 0.83 F10 (0.69) F10KLK1F2KCNH2
SCHEMBL5321809 0.82 F10 (0.68) F10KLK1F2KCNH2
SCHEMBL5324568 0.81 F10 (0.42) F10
SCHEMBL5706940 0.77 F10 (0.54) F10KLK1

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
WO-2007008144-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO claimed
WO-2007008144-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO disclosed