SCHEMBL5580165

SCHEMBL5580165

CCCCN1CCC2(CC1)CN(C(=O)c1cccc3ccccc13)Cc1ccccc12

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.52
EBP Q15125 1/20 0.50
HRH3 Q9Y5N1 1/20 0.44
AVPR1A P37288 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CNR2 P34972 1/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41

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
SCHEMBL5582460 0.81 GRIN2B (0.63) MEN1KMT2A
SCHEMBL5578791 0.81 SIGMAR1 (0.57) SIGMAR1EBPOPRK1OPRL1
SCHEMBL5580211 0.80 AVPR1A (0.43) AVPR1AMEN1KMT2A
SCHEMBL5578879 0.80 SIGMAR1 (0.54) SIGMAR1EBPOPRK1OPRL1
SCHEMBL5582419 0.78 MEN1 (0.46) AVPR1AMEN1KMT2A
SCHEMBL7919389 0.78 MEN1 (0.64) HRH3MEN1KMT2A
SCHEMBL5579023 0.78 SIGMAR1 (0.55) SIGMAR1EBPOPRK1OPRL1
Hydrochloric Acid SCHEMBL27556211 0.77 MEN1 (0.62) HRH3MEN1KMT2A
Hydrochloric Acid SCHEMBL27531033 0.77 MEN1 (0.62) HRH3MEN1KMT2A
Hydrochloric Acid SCHEMBL27491721 0.77 MEN1 (0.62) HRH3MEN1KMT2A

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 SIGMAR1 444/4885EBP 1262/4885HRH3 2438/4885

“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.