SCHEMBL5578634

SCHEMBL5578634

CC(O)CN1CCC2(CC1)CN(C(=O)c1ccccc1F)c1ccccc12

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.48
HDAC1 Q13547 3/20 0.47
HDAC6 Q9UBN7 3/20 0.47
PDE4B Q07343 1/20 0.46
SLC18A3 Q16572 3/20 0.43
SIGMAR1 Q99720 3/20 0.43
HDAC8 Q9BY41 1/20 0.41
P2RY1 P47900 1/20 0.40
HTT P42858 1/20 0.40
NPY5R Q15761 1/20 0.37

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
SCHEMBL5578644 0.88 HDAC1 (0.49) NOTUMHDAC1HDAC6SLC18A3SIGMAR1
SCHEMBL5578983 0.87 HDAC1 (0.53) NOTUMHDAC1HDAC6PDE4BSLC18A3
SCHEMBL5578448 0.83 NOTUM (0.48) NOTUMHDAC1HDAC6SLC18A3SIGMAR1
SCHEMBL5578977 0.82 NOTUM (0.50) NOTUMHDAC1HDAC6HTT
SCHEMBL5578690 0.82 HDAC1 (0.46) NOTUMHDAC1HDAC6SLC18A3SIGMAR1
SCHEMBL5579002 0.81 HDAC1 (0.59) NOTUMHDAC1HDAC6PDE4BSLC18A3
SCHEMBL5578501 0.78 NOTUM (0.50) NOTUMHDAC1HDAC6PDE4BSLC18A3
SCHEMBL5579110 0.76 HDAC1 (0.49) NOTUMHDAC1HDAC6PDE4BSLC18A3
SCHEMBL5578767 0.76 ATM (0.45) NOTUMHDAC1HDAC6SLC18A3SIGMAR1
SCHEMBL5578657 0.73 HTT (0.40) NOTUMHTT

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 8 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 claimed
WO-2005063745-A9 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF ARENA PHARM INC (US) 2007-02-01 WO claimed
EP-1716148-A2 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF Arena Pharmaceuticals, Inc. (US) 2006-11-02 EP claimed
WO-2005063745-A2 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2005-07-14 WO claimed
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 3318/4885HDAC1 885/4885HDAC6 767/4885

“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.