SCHEMBL5578765

SCHEMBL5578765

Cc1ccc(CN2CCC3(CC2)CN(C(=O)C(C)C)Cc2ccccc23)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.45
SIGMAR1 Q99720 6/20 0.43
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL5578642 0.85 GRIN2B (0.45) GRIN2BSIGMAR1KMT2A
SCHEMBL5582460 0.83 GRIN2B (0.63) GRIN2BMEN1KMT2A
SCHEMBL5578503 0.79 HDAC1 (0.50) GRIN2B
SCHEMBL5578791 0.79 SIGMAR1 (0.57) SIGMAR1
SCHEMBL12935283 0.78 SIGMAR1 (0.43) SIGMAR1MEN1KMT2A
SCHEMBL5578577 0.78 SMN1; SMN2 (0.48) MEN1KMT2A
SCHEMBL11939432 0.74 SIGMAR1 (0.46) SIGMAR1
SCHEMBL12935156 0.74 KCNH2 (0.56) SIGMAR1
SCHEMBL12935253 0.73 ALDH1A1 (0.44) SIGMAR1
SCHEMBL12935226 0.73 MPO (0.46) SIGMAR1

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 GRIN2B 555/4885SIGMAR1 444/4885MEN1 882/4885

“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.