SCHEMBL2223569

SCHEMBL2223569

CCCCCCCCCCCCCCC(C)COS(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
ACE2 Q9BYF1 1/20 0.46
SMPD1 P17405 3/20 0.38
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37
PRKCB P05771 1/20 0.37
PRKCA P17252 1/20 0.37
PRKCH P24723 1/20 0.37
PRKCI P41743 1/20 0.37
PRKCE Q02156 1/20 0.37
PRKCQ Q04759 1/20 0.37
PRKCZ Q05513 1/20 0.37
PRKCD Q05655 1/20 0.37
PRKD1 Q15139 1/20 0.37
CA1 P00915 6/20 0.37
CA2 P00918 6/20 0.37
CA9 Q16790 6/20 0.37
FDPS P14324 3/20 0.37
GPR84 Q9NQS5 2/20 0.37
CA12 O43570 2/20 0.37

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
SCHEMBL18855246 1.00 TP53 (0.48) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL3038910 1.00 TP53 (0.48) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL28631587 1.00 TP53 (0.48) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL2226071 1.00 TP53 (0.48) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL7031451 0.98 ACE2 (0.49) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL4773928 0.98 ACE2 (0.49) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL4772926 0.98 ACE2 (0.49) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL4780155 0.98 ACE2 (0.49) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL7023351 0.98 ACE2 (0.49) TP53ACE2SMPD1PRKD3PRKCG
SCHEMBL4772596 0.98 ACE2 (0.49) TP53ACE2SMPD1PRKD3PRKCG

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-8933131-B2 Intermediates and surfactants useful in household cleaning and personal care compositions, and methods of making the same THE PROCTER & GAMBLE COMPANY (US) 2015-01-13 US disclosed
EP-2523652-A1 INTERMEDIATES AND SURFACTANTS USEFUL IN HOUSEHOLD CLEANING AND PERSONAL CARE COMPOSITIONS, AND METHODS OF MAKING THE SAME The Procter & Gamble Company (US) 2012-11-21 EP disclosed
WO-2011088089-A1 INTERMEDIATES AND SURFACTANTS USEFUL IN HOUSEHOLD CLEANING AND PERSONAL CARE COMPOSITIONS, AND METHODS OF MAKING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2011-07-21 WO disclosed
US-20110171155-A1 Intermediates And Surfactants useful In Household Cleaning And Personal Care Compositions, And Methods Of Making The Same THE PROCTER & GAMBLE COMPANY 2011-07-14 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-20110171155-A1 Intermediates And Surfactants useful In Household Cleaning And Personal Care Compositions, And Methods Of Making The Same HACD2, DSG1, HACD3 TP53 2807/4885ACE2 4232/4885SMPD1 74/4885

“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.