SCHEMBL3393088

SCHEMBL3393088

CCOC(=O)C1CCCN1C(=O)C(C)NC(=O)CNC(=O)CCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.55
LMNA P02545 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.51
FKBP1A P62942 9/20 0.48

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
SCHEMBL13008499 1.00 ACE (0.55) ACELMNASMN1; SMN2FKBP1A
SCHEMBL9814463 0.85 ACE (0.53) ACELMNASMN1; SMN2FKBP1A
SCHEMBL3393053 0.84 PREP (0.52) FKBP1A
SCHEMBL13008125 0.84 PREP (0.52) FKBP1A
SCHEMBL30674429 0.82 ACE (0.50) ACELMNAFKBP1A
SCHEMBL26616455 0.82 ACE (0.64) ACELMNASMN1; SMN2
SCHEMBL26616457 0.82 ACE (0.64) ACELMNASMN1; SMN2
SCHEMBL26616386 0.82 ACE (0.64) ACELMNASMN1; SMN2
SCHEMBL31376307 0.82 ACE (0.64) ACELMNASMN1; SMN2
SCHEMBL26616380 0.82 ACE (0.64) ACELMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1737819-B1 AMINO ACID AND PEPTIDE CONJUGATES OF ARYLALKYLIC ACIDS FOR COSMETIC USE DSM IP ASSETS BV (NL) 2010-12-22 EP disclosed
US-20100099727-A1 Amino acid and peptide conjugates of arylalkylic acids for cosmetic use DSM IP ASSETS B.V. (NL) 2010-04-22 US disclosed
US-20080234344-A1 Amino Acid and Peptide Conjugates of Arylalkylic Acids for Cosmetic Use DSM IP ASSETS B.V. (NL) 2008-09-25 US disclosed
EP-1737819-A1 AMINO ACID AND PEPTIDE CONJUGATES OF ARYLALKYLIC ACIDS FOR COSMETIC USE DSMIP Assets B.V. (NL) 2007-01-03 EP disclosed
WO-2005092850-A1 AMINO ACID AND PEPTIDE CONJUGATES OF ARYLALKYLIC ACIDS FOR COSMETIC USE DSM IP ASSETS B.V. (NL) 2005-10-06 WO 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 (2 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-20080234344-A1 Amino Acid and Peptide Conjugates of Arylalkylic Acids for Cosmetic Use NGLY1, HRH4, C3AR1 ACE 1987/4885LMNA 3842/4885SMN1; SMN2 4745/4885
US-20100099727-A1 Amino acid and peptide conjugates of arylalkylic acids for cosmetic use NGLY1, HRH4, C3AR1 ACE 1987/4885LMNA 3842/4885SMN1; SMN2 4745/4885

“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.