SCHEMBL14769274

SCHEMBL14769274

N#Cc1ccc(C(=O)Nc2ccc(CO)cc2C(=O)Nc2ccc(Cl)cn2)cc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.67
KLKB1 P03952 3/20 0.62

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
SCHEMBL890676 0.90 F10 (0.74) F10KLKB1
SCHEMBL890632 0.88 F10 (0.71) F10KLKB1
SCHEMBL6713951 0.86 F10 (0.69) F10KLKB1
SCHEMBL799832 0.86 F10 (0.72) F10KLKB1
SCHEMBL12045550 0.83 F10 (0.68) F10KLKB1
SCHEMBL254113 0.83 F10 (0.72) F10KLKB1
SCHEMBL890619 0.83 F10 (0.72) F10
SCHEMBL28265311 0.83 RAB9A (0.68) F10
SCHEMBL799533 0.83 F10 (0.86) F10
Hydrochloric Acid SCHEMBL160886 0.83 F10 (0.71) F10KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170326119-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2017-11-16 US disclosed
US-9555023-B2 Pharmaceutical salts and polymorphs of a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-01-31 US disclosed
US-20160101089-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2016-04-14 US disclosed
US-9221758-B2 Methods of synthesizing pharmaceutical salts of a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-12-29 US disclosed
US-9061019-B2 Pharmaceutical salts and polymorphs of a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-20140288028-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2014-09-25 US disclosed
US-20140046071-A1 Methods of Synthesizing Pharmaceutical Salts of a Factor Xa Inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-02-13 US disclosed
US-20130064806-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2013-03-14 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 (5 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-20170326119-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KLKB1 177/4885
US-20140046071-A1 Methods of Synthesizing Pharmaceutical Salts of a Factor Xa Inhibitor F12, F11, TFPI F10 12/4885KLKB1 77/4885
US-20130064806-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KLKB1 177/4885
US-20140288028-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KLKB1 177/4885
US-20160101089-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KLKB1 177/4885

“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.