SCHEMBL1950508

SCHEMBL1950508

CS(=O)(=O)Nc1ccc(N2CCO[C@H]([C@@H](O)C(=O)Nc3ccc(C#N)cc3)C2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F9 P00740 12/20 0.57
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
PGR P06401 1/20 0.38
KDM1A O60341 1/20 0.37
PANK3 Q9H999 1/20 0.37
BCL2 P10415 1/20 0.36
BECN1 Q14457 1/20 0.36
CSF1R P07333 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
SCHEMBL1948290 0.89 F9 (0.72) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1947982 0.89 F9 (0.72) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1438536 0.88 F9 (0.62) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1950284 0.87 F9 (0.59) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1946415 0.87 F9 (0.58) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1949308 0.87 F9 (0.64) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1440773 0.86 F9 (0.58) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1944305 0.86 F9 (0.58) F9HDAC1HDAC8HDAC6
SCHEMBL1946866 0.86 F9 (0.58) F9HDAC1HDAC8HDAC6PANK3
SCHEMBL1949155 0.86 F9 (0.58) F9HDAC1HDAC8HDAC6KDM1A

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
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
US-8987242-B2 Morpholinone compounds as factor IXA inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 US disclosed
US-8642582-B2 Morpholinone compounds as factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2014-02-04 US disclosed
US-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 US disclosed
US-20110059958-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-10 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 (2 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 2/4885HDAC1 1052/4885HDAC8 327/4885
US-20110059958-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 F9 2/4885HDAC1 1052/4885HDAC8 327/4885

“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.