SCHEMBL6135010

SCHEMBL6135010

CC(NC(=O)OC(C)(C)C)C1CCN(Cc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.51
ACHE P22303 1/20 0.51
GPR119 Q8TDV5 1/20 0.48
KMT2A Q03164 4/20 0.47
BACE1 P56817 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ACE P12821 1/20 0.46
MEN1 O00255 1/20 0.46
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
MAPK1 P28482 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
SCHEMBL4505343 0.94 KMT2A (0.51) BCHEACHEGPR119KMT2AL3MBTL1
SCHEMBL9216093 0.88 BCHE (0.50) BCHEACHEGPR119KMT2ABACE1
SCHEMBL8634682 0.88 BCHE (0.50) BCHEACHEGPR119KMT2ABACE1
SCHEMBL9143719 0.88 BCHE (0.50) BCHEACHEGPR119KMT2ABACE1
SCHEMBL7502635 0.85 BCHE (0.50) BCHEACHEGPR119KMT2ABACE1
SCHEMBL7502637 0.85 BCHE (0.50) BCHEACHEGPR119KMT2ABACE1
SCHEMBL7387452 0.82 GPR119 (0.47) BCHEACHEGPR119BACE1CYP2D6
SCHEMBL5566771 0.81 BCHE (0.45) BCHEACHEGPR119KMT2ABACE1
SCHEMBL9384147 0.81 HRH2 (0.61) KMT2ABACE1L3MBTL1MEN1
SCHEMBL7568066 0.81 HRH2 (0.61) KMT2ABACE1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050222395-A1 New peptide derivatives ASTRAZENECA AB (SE) 2005-10-06 US disclosed
US-5476950-A Aminopyrrolidine compound DAIICHI SEIYAKU CO., LTD. (JP) 1995-12-19 US disclosed
US-5416222-A Chemical intermediates to prepare pyridinocarboxylic acid derivatives with high antimicrobial activity and excellent pharmacokinetics DAIICHI SEIYAKU CO., LTD. (JP) 1995-05-16 US disclosed
US-5380874-A Pyrrolidine carbamates DAIICHI SEIYAKU CO., LTD. (JP) 1995-01-10 US disclosed
US-5281612-A Naphthyridine antibacterial agents WARNER-LAMBERT COMPANY (US) 1994-01-25 US disclosed
EP-0207420-B1 PYRIDONECARBOXYLIC ACID DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1992-05-06 EP disclosed
US-5098912-A Bactericides for grampositive bacteria DAIICHI SEIYAKU CO., LTD. (JP) 1992-03-24 US disclosed
EP-0207420-A2 Pyridonecarboxylic acid derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 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 (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-20050222395-A1 New peptide derivatives SERPINE1, SERPINC1, SPINT2 BCHE 930/4885ACHE 1561/4885GPR119 1966/4885

“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.