SCHEMBL5989852

SCHEMBL5989852

CC(C)[Si](C#Cc1ccc2cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c4cc5cc(C#C[Si](C(C)C)(C(C)C)C(C)C)ccc5cc4c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc2c1)(C(C)C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP1B1 Q16678 1/20 0.36

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
SCHEMBL2162289 0.90 CYP1A1 (0.41) CYP1A1CYP1A2CYP1B1
SCHEMBL12278231 0.87 CYP1A1 (0.39) CYP1A1CYP1A2CYP1B1
SCHEMBL26259876 0.86 CYP1A2 (0.38) CYP1A1CYP1A2CYP1B1
SCHEMBL12269049 0.85 CYP1B1 (0.46) CYP1A1CYP1A2CYP1B1
SCHEMBL12269109 0.83 CYP1B1 (0.45) CYP1A1CYP1A2CYP1B1
SCHEMBL20044956 0.83 CACNA2D1 (0.35) CYP1A1CYP1A2CYP1B1
SCHEMBL497590 0.83 CYP1A1 (0.45) CYP1A1CYP1A2CYP1B1
SCHEMBL1270205 0.83 CACNA2D1 (0.35) CYP1A1CYP1A2CYP1B1
SCHEMBL12277770 0.83 CYP1A2 (0.46) CYP1A1CYP1A2CYP1B1
SCHEMBL12260023 0.83 CYP1A1 (0.47) CYP1A1CYP1A2CYP1B1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060267004-A1 Compounds comprising a linear series of five fused carbon rings, and preparation thereof UNIVERSITY OF OTTAWA (CA) 2006-11-30 US 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-20060267004-A1 Compounds comprising a linear series of five fused carbon rings, and preparation thereof JUP, LATS2, CDH1 CYP1A1 2576/4885CYP1A2 1807/4885CYP1B1 1021/4885

“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.