Cyclooctene

Cyclooctene

SCHEMBL164002

C1=C\CCCCCC/1.C1=C\CCCCCC/1.C1=C\CCCCCC/1.Cl/C1=C(\Cl)CCCCCC1.[Ir].[Ir]

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
CXCR3 P49682 1/20 0.31

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
SCHEMBL18112448 0.78
SCHEMBL16860545 0.78 TRIM24 (0.38)
SCHEMBL16860544 0.78 TRIM24 (0.38)
SCHEMBL31378988 0.76
Cyclooctene SCHEMBL8046390 0.74
Cyclooctene SCHEMBL7121430 0.74 HDAC3 (0.30) HDAC3HDAC4HDAC1HDAC7HDAC2
Cyclooctene SCHEMBL5279918 0.74 HDAC3 (0.30) HDAC3HDAC4HDAC1HDAC7HDAC2
Cyclooctene SCHEMBL5279923 0.74 HDAC3 (0.30) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10712112 0.74
Cyclooctene SCHEMBL7121436 0.74 HDAC3 (0.30) HDAC3HDAC4HDAC1HDAC7HDAC2

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
EP-1471567-B1 Organometallic iridium compounds, processes for producing the same, and processes for producing thin films TOSOH CORP (JP) 2009-03-11 EP disclosed
US-6884902-B2 Organometallic iridium compound, process of producing the same, and process of producing thin film TOSOH CORPORATION (JP) 2005-04-26 US disclosed
US-20040215029-A1 Novel organometallic iridium compound, process of producing the same, and process of producing thin film TOSOH CORPORATION 2004-10-28 US disclosed
EP-1471567-A1 Organometallic iridium compounds, processes for producing the same, and processes for producing thin films Tosoh Corporation (JP) 2004-10-27 EP 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-20040215029-A1 Novel organometallic iridium compound, process of producing the same, and process of producing thin film HMGCR, SREBF1, APOB HDAC3 4474/4885HDAC4 3609/4885HDAC1 2215/4885

“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.