SCHEMBL6712468

SCHEMBL6712468

O=CN(c1ccc(Cl)cn1)c1cc(F)ccc1NC(=O)c1ccc(C(=C2CCN2)N2CCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.40
KCNH2 Q12809 1/20 0.38
HDAC1 Q13547 1/20 0.35

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
SCHEMBL6712514 0.89 F10 (0.41) F10KCNH2
SCHEMBL6716150 0.84 F10 (0.42) F10KCNH2
SCHEMBL6718580 0.83 F10 (0.46) F10KCNH2
SCHEMBL6719151 0.82 F10 (0.44) F10KCNH2
SCHEMBL6711450 0.82 F10 (0.45) F10KCNH2
SCHEMBL6711451 0.81 F10 (0.40) F10
SCHEMBL6714441 0.77 MEN1 (0.38) F10
SCHEMBL6712477 0.76 KCNH2 (0.44) F10KCNH2
SCHEMBL6711620 0.75 KMT2A (0.33) F10HDAC1
SCHEMBL7013030 0.74 F10 (0.31) F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077690-A1 Quaternary amidino based inhibitors of factor xa MILLENNIUM PHARMACEUTICALS, INC. 2004-04-22 US disclosed
EP-1322637-A2 QUATERNARY AMIDINO BASED INHIBITORS OF FACTOR XA Millennium Pharmaceuticals, Inc. (US) 2003-07-02 EP disclosed
WO-2002026731-A2 QUATERNARY AMIDINO BASED INHIBITORS OF FACTOR XA MILLENIUM PHARMACEUTICALS, INC. (US) 2002-04-04 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-20040077690-A1 Quaternary amidino based inhibitors of factor xa F12, TFPI, F11 F10 15/4885KCNH2 2891/4885HDAC1 164/4885

“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.