SCHEMBL5427299

SCHEMBL5427299

CCOC(=O)N1C[C@H](NC(=O)c2ccc(N3CCOCC3=O)cc2)[C@H](NC(=O)c2ccc(Cl)s2)C1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.66
F2 P00734 4/20 0.66
F11 P03951 2/20 0.66
ABCB11 O95342 1/20 0.56
ST14 Q9Y5Y6 1/20 0.56

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
SCHEMBL5432804 0.91 F10 (0.65) F10F2F11ABCB11ST14
SCHEMBL5631625 0.91 F10 (0.65) F10F2F11ABCB11ST14
SCHEMBL5631218 0.89 F10 (0.64) F10F2F11ABCB11ST14
SCHEMBL5442200 0.89 F10 (0.64) F10F2F11ABCB11ST14
SCHEMBL5432632 0.87 F10 (0.65) F10F2F11ABCB11ST14
SCHEMBL5432864 0.87 F10 (0.71) F10F2F11
SCHEMBL5630640 0.87 F10 (0.65) F10F2F11ABCB11ST14
SCHEMBL5427087 0.86 F10 (0.56) F10F2F11ABCB11ST14
SCHEMBL5632250 0.86 F10 (0.56) F10F2F11ABCB11ST14
SCHEMBL5429924 0.85 F10 (0.59) F10F2F11ABCB11ST14

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
US-20070135428-A1 LACTAM CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS QIAO JENNIFER X 2007-06-14 US disclosed
US-7205318-B2 Lactam-containing cyclic diamines and derivatives as a factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-17 US 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-20070135428-A1 LACTAM CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS F12, F2, PEPD F10 53/4885F2 2/4885F11 7/4885

“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.