SCHEMBL7969986

SCHEMBL7969986

Cn1nc(-c2ccc(Br)cc2)c(O)c1-c1nc2ccc(C(=N)N)cc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.58
F9 P00740 4/20 0.58
F11 P03951 3/20 0.58
F2 P00734 10/20 0.56
PLAU P00749 10/20 0.56
PRSS1 P07477 10/20 0.56
PLG P00747 9/20 0.56
PLAT P00750 8/20 0.56
F7 P08709 3/20 0.53
HPN P05981 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48

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
SCHEMBL10140709 0.92 F10 (0.48) F10F9F11F2PLAU
SCHEMBL7975521 0.90 F10 (0.63) F10F9F11F2PLAU
SCHEMBL7959084 0.90 CHEK2 (0.60)
SCHEMBL10140008 0.89 F10 (0.57) F10F9F11F2PLAU
SCHEMBL7960525 0.85 F10 (0.56) F10F9F11F2PLAU
SCHEMBL10139901 0.85 F10 (0.54) F10F9F11F2PLAU
SCHEMBL10140012 0.85 F10 (0.56) F10F9F11F2PLAU
SCHEMBL10139996 0.85 F10 (0.54) F10F9F11F2PLAU
SCHEMBL16258934 0.85 F10 (0.54) F10F9F11F2PLAU
SCHEMBL10173098 0.85 F10 (0.54) F10F9F11F2PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2805939-A1 Heterocyclic compounds as factor IXA inhibitors. Merck Sharp & Dohme Corp. (US) 2014-11-26 EP disclosed
US-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
WO-2009143039-A2 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS SCHERING CORPORATION (US) 2009-11-26 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-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS F9, F12, F8 F10 11/4885F9 1/4885F11 4/4885

“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.