SCHEMBL3486738

SCHEMBL3486738

CC(C)[C@@H](NC(=O)[C@H](CS)NC(=O)Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 12/20 0.47
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
THRA P10827 2/20 0.42
THRB P10828 2/20 0.42
CHRNA1 P02708 1/20 0.42
CHRNG P07510 1/20 0.42
CHRNB1 P11230 1/20 0.42
CHRND Q07001 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL15387515 0.90 MME (0.55) MMEALDH1A1MAPTHPGD
SCHEMBL9633609 0.90 MME (0.55) MMEALDH1A1MAPTHPGD
SCHEMBL15387514 0.90 MME (0.55) MMEALDH1A1MAPTHPGD
SCHEMBL15156774 0.83 MME (0.45) MMEACECPA1ACE2ALDH1A1
SCHEMBL15156784 0.83 MME (0.45) MMEACECPA1ACE2ALDH1A1
SCHEMBL3487775 0.83 MME (0.45) MMEACECPA1ACE2ALDH1A1
SCHEMBL3488160 0.83 MME (0.45) MMEACECPA1ACE2ALDH1A1
SCHEMBL9654344 0.81 MEP1B (0.50) MME
SCHEMBL9657153 0.81 MEP1B (0.50) MME
SCHEMBL31074731 0.78 OPRD1 (0.49) MMEACECPA1ACE2CHRNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835132-B2 Method for making acylated polypeptides NOVO NORDISK A/S (DK) 2014-09-16 US disclosed
EP-2084270-B1 PRODUCTION OF BETA-LACTAM ANTIBIOTICS DSM SINOCHEM PHARM NL BV (NL) 2013-11-20 EP disclosed
US-8293511-B2 Production of β-Lactam antibiotics DSM IP ASSETS B.V. (NL) 2012-10-23 US disclosed
US-20100055738-A1 Method for Making Acylated Polypeptides NOVO NORDISK A/S (DK) 2010-03-04 US disclosed
US-20100009404-A1 PRODUCTION OF BETA-LACTAM ANTIBIOTICS DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2010-01-14 US disclosed
US-7595172-B2 Expressing a precursor polypeptide that has an n-terminal extension cleavable from the polypeptide at a lysine cleavage site, acylating and removing N-terminal extension by enzymatic cleavage NOVO NORDISK A/S (DK) 2009-09-29 US disclosed
EP-2084270-A2 PRODUCTION OF BETA-LACTAM ANTIBIOTICS DSMIP Assets B.V. (NL) 2009-08-05 EP disclosed
EP-1421103-B1 METHOD FOR MAKING ACYLATED POLYPEPTIDES NOVO NORDISK AS (DK) 2008-10-15 EP disclosed
WO-2008040731-A2 PRODUCTION OF BETA-LACTAM ANTIBIOTICS DSM IP ASSETS B.V. (NL) 2008-04-10 WO disclosed
EP-1421103-A2 METHOD FOR MAKING ACYLATED POLYPEPTIDES NOVO NORDISK A/S (DK) 2004-05-26 EP disclosed
US-20030144471-A1 Expressing a precursor polypeptide that has an n-terminal extension cleavable from the polypeptide at a lysine cleavage site, acylating and removing N-terminal extension by enzymatic cleavage NOVO NORDISK A/S (DK) 2003-07-31 US disclosed
WO-2003010186-A2 METHOD FOR MAKING ACYLATED POLYPEPTIDES NOVO NORDISK A/S (DK) 2003-02-06 WO disclosed