SCHEMBL5497946

SCHEMBL5497946

CCCOC(=O)C1CCCN1C(=O)CCCCC(=O)N1CCCC1C(=O)OCCC

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 10/20 0.47
SPHK1 Q9NYA1 1/20 0.45

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
SCHEMBL6883802 1.00 FKBP1A (0.47) FKBP1ASPHK1
SCHEMBL5492839 1.00 FKBP1A (0.47) FKBP1ASPHK1
SCHEMBL7048968 0.95 ACE (0.50) FKBP1A
SCHEMBL6883743 0.93 FKBP1A (0.49) FKBP1ASPHK1
SCHEMBL5497995 0.93 FKBP1A (0.49) FKBP1ASPHK1
SCHEMBL5497998 0.93 FKBP1A (0.49) FKBP1ASPHK1
SCHEMBL16116984 0.90 SPHK1 (0.48) FKBP1ASPHK1
SCHEMBL16116973 0.90 SPHK1 (0.48) FKBP1ASPHK1
SCHEMBL4186745 0.88 FKBP1A (0.46) FKBP1A
SCHEMBL5496862 0.88 FKBP1A (0.53) FKBP1ASPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1743884-A1 Progrugs to d-prolines F.HOFFMANN-LA ROCHE AG (CH) 2007-01-17 EP claimed
US-6903129-B2 D-proline prodrugs HOFFMAN-LA ROCHE INC. (US) 2005-06-07 US claimed
US-20030134891-A1 New D-proline prodrugs PENTRAXIN THERAPEUTICS LTD. (GB) 2003-07-17 US claimed
EP-1743884-A1 Progrugs to d-prolines F.HOFFMANN-LA ROCHE AG (CH) 2007-01-17 EP disclosed
US-6903129-B2 D-proline prodrugs HOFFMAN-LA ROCHE INC. (US) 2005-06-07 US disclosed
US-20030134891-A1 New D-proline prodrugs PENTRAXIN THERAPEUTICS LTD. (GB) 2003-07-17 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-20030134891-A1 New D-proline prodrugs PCNP, PREP, APP FKBP1A 203/4885SPHK1 1147/4885

“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.