SCHEMBL7208206

SCHEMBL7208206

Cc1ccc(S(=O)(=O)NC(CCc2ccc(C(=N)N)cc2)C(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPN P05981 10/20 0.74
PLAU P00749 9/20 0.74
ITGB3 P05106 6/20 0.71
ITGA2B P08514 6/20 0.71
TDP1 Q9NUW8 1/20 0.61
MMP9 P14780 1/20 0.51
ALDH1A1 P00352 1/20 0.50
F2 P00734 1/20 0.50

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
SCHEMBL7363270 0.88 TDP1 (0.78) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL7363271 0.88 TDP1 (0.78) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL7418027 0.79 ITGB3 (0.62) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL7418020 0.79 ITGB3 (0.62) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL3458998 0.78 MMP9 (0.76) ITGB3ITGA2BTDP1MMP9
SCHEMBL21538609 0.78 MMP9 (0.76) ITGB3ITGA2BTDP1MMP9
SCHEMBL1509767 0.77 ITGB3 (0.71) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL9293208 0.77 ITGB3 (0.71) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL1509766 0.77 ITGB3 (0.71) HPNPLAUITGB3ITGA2BTDP1
SCHEMBL7752365 0.76 ITGB3 (0.62) HPNPLAUITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6613324-B1 Comprising: fibrinogen; batroxobin; fibronectin; reducing agent; calcium chloride; and activated blood coagulation factor XIII; permitting batroxobin to split fibrinopeptide A, from said fibrinogen, thereby gluing tissue BRISTOL-MYERS SQUIBB COMPANY 2003-09-02 US claimed