SCHEMBL2781702

SCHEMBL2781702

CCNNC(Cc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.51
ACE P12821 2/20 0.51
CPA1 P15085 2/20 0.51
ACE2 Q9BYF1 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NPSR1 Q6W5P4 1/20 0.50
LMNA P02545 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NAALAD2 Q9Y3Q0 1/20 0.49
CYP1A2 P05177 1/20 0.48
MMP2 P08253 4/20 0.48
MMP9 P14780 3/20 0.48
ADAMTS4 O75173 1/20 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
SCHEMBL2781698 1.00 MME (0.51) MMEACECPA1ACE2L3MBTL1
SCHEMBL2778934 0.87 POLB (0.52) MMEACECPA1ACE2L3MBTL1
SCHEMBL30380582 0.87 FOLH1 (0.55) MMEACECPA1ACE2L3MBTL1
SCHEMBL16976343 0.87 MME (0.46) MMEACECPA1ACE2L3MBTL1
SCHEMBL2778931 0.87 POLB (0.52) MMEACECPA1ACE2L3MBTL1
SCHEMBL157547 0.85 MME (0.61) MMEACECPA1ACE2L3MBTL1
SCHEMBL18306672 0.83 PAM (0.51) MMEACECPA1ACE2L3MBTL1
SCHEMBL30358457 0.83 NAALAD2 (0.53) MMEL3MBTL1NPSR1NAALAD2CYP1A2
SCHEMBL9178000 0.82 MME (0.54) MMEACECPA1ACE2L3MBTL1
SCHEMBL9178006 0.82 MME (0.54) MMEACECPA1ACE2L3MBTL1

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-2248901-A1 Streptogramines and method for preparing same by mutasynthesis Aventis Pharma S.A. (FR) 2010-11-10 EP disclosed
EP-0770132-B1 NEW STREPTOGRAMINES AVENTIS PHARMA SA (FR) 2010-09-08 EP disclosed
CN-1152338-A Streptogramines and method for preparing same by mutasynthesis RHONE POULENC RORER SA (FR) 1997-06-18 CN disclosed
EP-0770132-A1 STREPTOGRAMINES AND METHOD FOR PREPARING SAME BY MUTASYNTHESIS Aventis Pharma S.A. (FR) 1997-05-02 EP disclosed
WO-1996001901-A1 STREPTOGRAMINES AND METHOD FOR PREPARING SAME BY MUTASYNTHESIS RHONE-POULENC RORER S.A. (FR) 1996-01-25 WO disclosed