SCHEMBL9900366

SCHEMBL9900366

COC(=O)c1ccc(C2(NC(=O)c3cc(F)cnc3N3CC(Nc4ccc(F)cc4C)C3)CC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.39
IDO1 P14902 6/20 0.37
GRM4 Q14833 1/20 0.36
MAST3 O60307 1/20 0.34
MAPK8 P45983 1/20 0.34
DHODH Q02127 1/20 0.34
CTSS P25774 2/20 0.33
LMNA P02545 1/20 0.33
GPR6 P46095 2/20 0.33

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
SCHEMBL15294771 0.94 OPRK1 (0.37) OPRK1IDO1MAST3MAPK8DHODH
SCHEMBL9900472 0.93 GRM4 (0.38) OPRK1IDO1GRM4MAST3MAPK8
SCHEMBL9900786 0.92 GRM4 (0.36) IDO1GRM4MAST3MAPK8DHODH
SCHEMBL9901591 0.92 SCN10A (0.40) GRM4
SCHEMBL15294772 0.88 GPR6 (0.39) OPRK1IDO1MAST3MAPK8DHODH
SCHEMBL15294801 0.86 MAPK8 (0.36) IDO1MAST3MAPK8DHODHCTSS
SCHEMBL9901535 0.86 GRM4 (0.38) OPRK1IDO1GRM4DHODHCTSS
SCHEMBL9901219 0.85 SCN10A (0.38) GRM4
SCHEMBL9901255 0.85 GRM4 (0.39) IDO1GRM4MAST3MAPK8CTSS
SCHEMBL9901200 0.85 SCN10A (0.40) IDO1GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649061-B1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Rottapharm Biotech Srl (IT) 2015-05-13 EP disclosed
EP-2649061-B1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Rottapharm Biotech Srl (IT) 2015-05-13 EP disclosed
US-8828987-B2 Pyridine amide derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2014-09-09 US disclosed
US-8828987-B2 Pyridine amide derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2014-09-09 US disclosed
US-8828987-B2 Pyridine amide derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2014-09-09 US disclosed
EP-2649061-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Rottapharm S.p.A. (IT) 2013-10-16 EP disclosed
US-20130261100-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2013-10-03 US disclosed
US-20130261100-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2013-10-03 US disclosed
US-20130261100-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2013-10-03 US disclosed
WO-2012076063-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM S.P.A. (IT) 2012-06-14 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-20130261100-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, CNR1 OPRK1 26/4885IDO1 1055/4885GRM4 278/4885

“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.