SCHEMBL3392569

SCHEMBL3392569

CCOC(=O)CNC(=O)CCCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.62
HDAC3 O15379 2/20 0.60
HDAC1 Q13547 2/20 0.60
HDAC2 Q92769 2/20 0.60
HDAC8 Q9BY41 2/20 0.60
HDAC6 Q9UBN7 2/20 0.60
HDAC5 Q9UQL6 2/20 0.60
HDAC4 P56524 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC10 Q969S8 1/20 0.60
HDAC11 Q96DB2 1/20 0.60
HDAC9 Q9UKV0 1/20 0.60
NCOR2 Q9Y618 1/20 0.60
PPID Q08752 1/20 0.59
HPGD P15428 2/20 0.57
ALOX5 P09917 1/20 0.56
POLB P06746 1/20 0.56
LMNA P02545 1/20 0.55
PKM P14618 1/20 0.55
ALDH1A1 P00352 1/20 0.54

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
SCHEMBL9369849 0.96 GAA (0.65) GAAHDAC3HDAC1HDAC2HDAC8
SCHEMBL3665504 0.91 PPID (0.62) GAAHDAC3HDAC1HDAC2HDAC8
SCHEMBL3393059 0.87 POLB (0.71) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL13851687 0.87 ALDH1A1 (0.62) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL260297 0.83 ALOX5 (0.76) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL25365126 0.83 HDAC1 (0.55) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL30385493 0.82 PPID (0.66) GAAHDAC6HDAC4PPIDPOLB
SCHEMBL8030811 0.82 GAA (0.61) GAAHDAC3HDAC1HDAC2HDAC8
Hydrochloric Acid SCHEMBL27794216 0.82 ALOX5 (0.74) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL21485092 0.81 HPGD (0.55) HDAC3HDAC1HDAC2HDAC8HDAC6

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 14 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
CN-1934080-A Amino acid and peptide conjugates of arylalkylic acids for cosmetic use DSM IP ASSETS BV (NL) 2007-03-21 CN 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
EP-0207684-B1 7-Oxabicycloheptane substituted diamide and its congener prostaglandin analogs SQUIBB & SONS INC (US) 1994-11-23 EP disclosed
US-4738978-A ANTICOAGULANT, ANTIALLERGENS E. R. SQUIBB & SONS, INC. (US) 1988-04-19 US disclosed
US-4735962-A ANTICOAGULANTS, BRONCHODILATORS E. R. SQUIBB & SONS, INC. (US) 1988-04-05 US disclosed
US-4734424-A ANTICOAGULANTS E. R. SQUIBB & SONS, INC. (US) 1988-03-29 US disclosed
US-4734426-A CARDIOVASCULAR AGENTS E. R. SQUIBB & SONS, INC. (US) 1988-03-29 US disclosed
US-4734425-A CARDIOVASCULAR AGENTS E. R. SQUIBB & SONS, INC. (US) 1988-03-29 US disclosed
US-4663336-A ANTICOAGULANTS E. R. SQUIBB & SONS, INC. (US) 1987-05-05 US disclosed
EP-0207684-A2 7-Oxabicycloheptane substituted diamide and its congener prostaglandin analogs E.R. Squibb & Sons, Inc. (US) 1987-01-07 EP 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 GAA 2203/4885HDAC3 3471/4885HDAC1 3617/4885
US-20100099727-A1 Amino acid and peptide conjugates of arylalkylic acids for cosmetic use NGLY1, HRH4, C3AR1 GAA 2203/4885HDAC3 3471/4885HDAC1 3617/4885

“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.