SCHEMBL5578781

SCHEMBL5578781

CCOC(=O)CN1CCC2(CC1)CN(C(=O)c1c(F)cccc1F)c1ccc(Cl)cc12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
EPHX2 P34913 1/20 0.37
MGLL Q99685 4/20 0.37
XIAP P98170 3/20 0.37
BIRC2 Q13490 3/20 0.37
USP2 O75604 1/20 0.37
HTT P42858 1/20 0.37
RORC P51449 1/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 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
SCHEMBL5579118 0.91 NOTUM (0.44) NOTUMMGLLXIAPBIRC2USP2
SCHEMBL5578912 0.88 NOTUM (0.49) NOTUMEPHX2XIAPBIRC2RORC
SCHEMBL5579025 0.85 NOTUM (0.47) NOTUMEPHX2XIAPBIRC2RORC
SCHEMBL5578441 0.85 NOTUM (0.48) NOTUMEPHX2XIAPBIRC2RORC
SCHEMBL5578755 0.84 NOTUM (0.47) NOTUMEPHX2HTTRORC
SCHEMBL5578845 0.83 NOTUM (0.46) NOTUMEPHX2XIAPBIRC2RORC
SCHEMBL5578546 0.83 NOTUM (0.46) NOTUMEPHX2RORCMEN1KMT2A
SCHEMBL5780997 0.82 NOTUM (0.44) NOTUMEPHX2XIAPBIRC2RORC
SCHEMBL5578799 0.82 MEN1 (0.46) NOTUMEPHX2MEN1KMT2A
SCHEMBL5578802 0.81 NOTUM (0.51) NOTUMEPHX2XIAPBIRC2RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US disclosed
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US disclosed
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US disclosed
WO-2005063745-A9 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF ARENA PHARM INC (US) 2007-02-01 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-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof REN, AVPR2, RECQL NOTUM 3318/4885EPHX2 157/4885MGLL 3510/4885

“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.