SCHEMBL860608

SCHEMBL860608

COCCNS(=O)(=O)c1ccc(C(C)NC(=O)CC(=O)Nc2ccc(C(=N)N)cc2)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F7 P08709 14/20 0.47
F2 P00734 12/20 0.47
F10 P00742 3/20 0.42
TMPRSS6 Q8IU80 3/20 0.42
CNR2 P34972 1/20 0.42
GSTO1 P78417 1/20 0.41

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
SCHEMBL860363 1.00 F7 (0.47) F7F2F10TMPRSS6CNR2
SCHEMBL860396 0.89 F7 (0.47) F7F2F10TMPRSS6
SCHEMBL861018 0.86 F7 (0.46) F7F2F10CNR2GSTO1
SCHEMBL860615 0.86 F7 (0.46) F7F2F10CNR2GSTO1
SCHEMBL860480 0.85 F7 (0.48) F7F2F10CNR2
SCHEMBL860288 0.85 F7 (0.49) F7F2F10
SCHEMBL860931 0.83 CNR2 (0.48) F7F2CNR2
SCHEMBL860927 0.83 F7 (0.48) F7F2F10
SCHEMBL842037 0.82 F7 (0.50) F7F2F10
SCHEMBL841073 0.82 F7 (0.50) F7F2F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143242-B2 Malonamide derivatives with antithrombotic activity SANOFI-AVENTIS (FR) 2012-03-27 US disclosed
US-8143242-B2 Malonamide derivatives with antithrombotic activity SANOFI-AVENTIS (FR) 2012-03-27 US disclosed
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
WO-2009007015-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2009-01-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY F7, F9, TFPI F7 1/4885F2 23/4885F10 12/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.