SCHEMBL5643585

SCHEMBL5643585

CN(C)CC1(c2ccc(N3CC(CNC(=O)c4cc5ccc(Cl)nc5s4)CC3=O)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.36
FPR2 P25090 1/20 0.34
F2 P00734 1/20 0.33
POLB P06746 1/20 0.33
ENPP2 Q13822 1/20 0.33
LMNA P02545 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL5640860 0.89 F10 (0.35) F10FPR2F2POLBENPP2
SCHEMBL5638175 0.87 F10 (0.40) F10FPR2F2ENPP2
SCHEMBL5640819 0.87 F10 (0.41) F10POLBENPP2LMNASLC6A4
SCHEMBL5640071 0.85 F10 (0.41) F10POLBENPP2LMNASLC6A4
SCHEMBL4588148 0.84 F10 (0.51) F10F2
SCHEMBL5639833 0.84 OPRM1 (0.42) F10SLC6A4SLC6A3
SCHEMBL5640108 0.84 F10 (0.34) F10FPR2POLBENPP2LMNA
SCHEMBL5642046 0.83 F10 (0.46) F10F2
SCHEMBL5641253 0.82 F10 (0.44) F10
SCHEMBL5642913 0.81 PYGL (0.34) F10FPR2POLB

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-7199149-B2 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2007-04-03 US disclosed
US-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMANY 2005-05-19 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-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors F2, F12, SPINT2 F10 18/4885FPR2 3505/4885F2 1/4885

“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.