SCHEMBL1950503

SCHEMBL1950503

N#Cc1ccccc1N1CCO[C@H](C(O)C(=O)Nc2ccc(C(=N)N)cc2)C1=O

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F9 P00740 11/20 0.67
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NAMPT P43490 1/20 0.37
F2 P00734 7/20 0.37
F10 P00742 3/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36

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
SCHEMBL12547899 1.00 F9 (0.67) F9TDP1L3MBTL1NAMPTF2
SCHEMBL7901577 0.88 F9 (0.70) F9F2F10PLGPLAU
SCHEMBL1948970 0.86 F9 (0.68) F9F2F10PLGPLAU
SCHEMBL1439019 0.84 F9 (0.65) F9TDP1L3MBTL1NAMPT
SCHEMBL12545890 0.84 F9 (0.82) F9F2F10PLGPLAU
SCHEMBL17237641 0.84 F9 (0.68) F9F2F10PLGPLAU
SCHEMBL1947953 0.84 F9 (0.68) F9L3MBTL1F2F10ITGB3
SCHEMBL1947490 0.83 F9 (0.63) F9F2F10PLGPLAU
SCHEMBL1948534 0.83 F9 (0.66) F9F2F10PLGPLAU
SCHEMBL1947068 0.82 F9 (0.62) F9F2F10ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987242-B2 Morpholinone compounds as factor IXA inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 US claimed
EP-2473491-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2013-07-17 EP claimed
US-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 US claimed
US-8987242-B2 Morpholinone compounds as factor IXA inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 US disclosed
US-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 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-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 F9 2/4885TDP1 1543/4885L3MBTL1 3657/4885

“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.