SCHEMBL6778043

SCHEMBL6778043

N=C(N)c1cccc(NC(C(=O)NCC(=O)N2CCN(c3ccncc3)CC2)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.61
F2 P00734 8/20 0.61
PRSS1 P07477 8/20 0.61
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
TNKS O95271 1/20 0.39
PARP1 P09874 1/20 0.39
PARP14 Q460N5 1/20 0.39
HPN P05981 1/20 0.39
HGFAC Q04756 1/20 0.39
ST14 Q9Y5Y6 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
SCHEMBL6775712 0.88 F10 (0.47) F10F2PRSS1HPNHGFAC
SCHEMBL6775750 0.88 MAPT (0.51) F10F2PRSS1KMT2AGAA
SCHEMBL27579772 0.87 F10 (0.50) F10F2PRSS1KMT2AGAA
SCHEMBL6785087 0.83 MAPT (0.46) F10F2PRSS1KMT2AGAA
SCHEMBL6780731 0.83 F10 (0.46) F10F2PRSS1KMT2A
SCHEMBL6897423 0.83 F10 (0.48) F10F2PRSS1KMT2ATNKS
SCHEMBL6780268 0.83 F10 (0.46) F10F2PRSS1KMT2AGAA
SCHEMBL6784570 0.81 F10 (0.49) F10F2PRSS1
SCHEMBL6778302 0.80 POLB (0.45) F10F2PRSS1KMT2AST14
SCHEMBL6774655 0.79 GFER (0.47) F10F2PRSS1KMT2AGAA

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-6794507-B2 Compounds that inhibit factor Xa activity MORPHOCHEM AG (DE) 2004-09-21 US disclosed
CN-1460101-A Novel compounds that inhibit factor Xa activity MORPHOCHEM AG (DE) 2003-12-03 CN disclosed
US-20030153510-A1 Novel compounds inhibiting factor xa activity CAPPI MICHAEL W (DE) 2003-08-14 US disclosed
EP-1311473-A2 NOVEL COMPOUNDS INHIBITING FACTOR XA ACTIVITY Morphochem AG (DE) 2003-05-21 EP disclosed
WO-2002016312-A2 NOVEL COMPOUNDS INHIBITING FACTOR XA ACTIVITY MORPHOCHEM AG (DE) 2002-02-28 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-20030153510-A1 Novel compounds inhibiting factor xa activity SERPINC1, F11, TFPI F10 6/4885F2 7/4885PRSS1 51/4885

“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.