SCHEMBL10018323

SCHEMBL10018323

CC(=O)CCCCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 6/20 0.41
DUT P33316 2/20 0.37
ALDH1A1 P00352 2/20 0.34
CES2 O00748 1/20 0.32
ACHE P22303 1/20 0.32
TSHR P16473 2/20 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
SCHEMBL3217922 0.98 DUT (0.38) PAOXDUTALDH1A1ACHE
SCHEMBL875754 0.92 DUT (0.39) PAOXDUTALDH1A1ACHE
SCHEMBL30864486 0.85 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL9842173 0.85 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL1930904 0.85 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL8014066 0.85 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL4844799 0.85 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL7562345 0.85 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL1454793 0.84 ALDH1A1 (0.38) DUTALDH1A1
SCHEMBL8030008 0.84 ALDH1A1 (0.44) DUTALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680327-B2 Methods for manufacturing tetranor-prostaglandin D, J, E, A and F metabolites CAYMAN CHEMICAL COMPANY, INCORPORATED (US) 2014-03-25 US disclosed
US-20120041229-A1 METHODS FOR MANUFACTURING TETRANOR-PROSTAGLANDIN D, J, E, A AND F METABOLITES CAYMAN CHEMICAL COMPANY, INCORPORATED (US) 2012-02-16 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-20120041229-A1 METHODS FOR MANUFACTURING TETRANOR-PROSTAGLANDIN D, J, E, A AND F METABOLITES PTGES, PTGDR, PTGIR PAOX 324/4885DUT 586/4885ALDH1A1 420/4885

“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.