SCHEMBL5578683

SCHEMBL5578683

O=C(C1CCC1)N1CCC2(CC1)CN(Cc1ccc(Cl)c(Cl)c1)c1ccccc12

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 9/20 0.52
HDAC6 Q9UBN7 9/20 0.52
HDAC8 Q9BY41 4/20 0.48
TACR1 P25103 7/20 0.43
NPY5R Q15761 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL5578876 0.79 SIGMAR1 (0.44) ALDH1A1MEN1MAPK1KMT2A
SCHEMBL5578865 0.79 HTT (0.47) HDAC1HDAC6HDAC8ALDH1A1MEN1
SCHEMBL5578454 0.78 HDAC1 (0.44) HDAC1HDAC6HDAC8ALDH1A1MEN1
SCHEMBL5578515 0.77 HDAC1 (0.44) HDAC1HDAC6HDAC8NPY5RALDH1A1
SCHEMBL5578870 0.76 HCRTR1 (0.43) HDAC1HDAC6HDAC8ALDH1A1MEN1
SCHEMBL5578893 0.75 HDAC1 (0.46) HDAC1HDAC6HDAC8TACR1MEN1
SCHEMBL2801717 0.74 HDAC1 (0.65) HDAC1HDAC6HDAC8TACR1NPY5R
SCHEMBL14391830 0.73 HDAC1 (0.40) HDAC1HDAC6HDAC8ALDH1A1MEN1
SCHEMBL11290928 0.72 HDAC1 (0.46) HDAC1HDAC6HDAC8ALDH1A1
SCHEMBL14391837 0.70 SIGMAR1 (0.41) ALDH1A1MEN1MAPK1KMT2A

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
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US 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 HDAC1 885/4885HDAC6 767/4885HDAC8 2130/4885

“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.