SCHEMBL1947091

SCHEMBL1947091

CCOC(=O)CN(C)C(=O)c1cccc(N2CCO[C@H]([C@@H](O)C(=O)Nc3ccc4c(c3)CNC4=N)C2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F9 P00740 11/20 0.49
L3MBTL1 Q9Y468 6/20 0.34
TDP1 Q9NUW8 4/20 0.34
CASP6 P55212 3/20 0.34
CTDSP1 Q9GZU7 3/20 0.34
DNMT1 P26358 2/20 0.34
PSMD14 O00487 1/20 0.34
MMP2 P08253 1/20 0.34
CASP8 Q14790 1/20 0.33
KMT2A Q03164 1/20 0.33
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL1438658 0.94 F9 (0.51) F9L3MBTL1TDP1CASP6CTDSP1
SCHEMBL1438513 0.92 F9 (0.49) F9L3MBTL1TDP1CASP6CTDSP1
SCHEMBL1442236 0.91 F9 (0.50) F9L3MBTL1TDP1CASP6CTDSP1
SCHEMBL1440748 0.90 F9 (0.47) F9L3MBTL1TDP1DNMT1KMT2A
SCHEMBL1438264 0.89 F9 (0.48) F9L3MBTL1TDP1CASP6CTDSP1
SCHEMBL12569614 0.89 F9 (0.50) F9L3MBTL1KMT2AMCL1
SCHEMBL7902929 0.89 F9 (0.52) F9KMT2AMCL1
SCHEMBL1947223 0.89 F9 (0.52) F9KMT2AMCL1
SCHEMBL1438039 0.89 F9 (0.49) F9L3MBTL1TDP1
SCHEMBL1441849 0.87 F9 (0.49) F9

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

“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.