SCHEMBL3740930

SCHEMBL3740930

CCCCCCCC(C(=O)O)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CNR2 P34972 6/20 0.43
CNR1 P21554 4/20 0.43
ALOX5 P09917 1/20 0.43
CYSLTR2 Q9NS75 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
EPHX2 P34913 2/20 0.41
TACR3 P29371 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
SCHEMBL1826965 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL2028355 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL5357939 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL8015861 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL2536987 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL2024342 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL451183 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL5156697 0.99 KDM4E (0.47) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL6842064 0.94 ALOX5 (0.44) KDM4EKMT2AL3MBTL1ALOX5CYP2C9
SCHEMBL5351493 0.92 FAAH (0.45) KDM4EKMT2AL3MBTL1CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4308348-A SALMONELLA, SERRATIA, PROTEUS, PROVIDENCIA LABORATOIRE DE RECHERCHE API (FR) 1981-12-29 US claimed
CN-101970682-B Method for detecting and/or identifying clostridium difficile BIOMERIEUX SA 2015-05-13 CN disclosed
US-8404460-B2 Method for detecting and/or identifying Clostridium difficile BIOMERIEUX (FR) 2013-03-26 US disclosed
CN-101970682-A Method for detecting and/or identifying clostridium difficile BIOMERIEUX SA 2011-02-09 CN disclosed
US-20100279330-A1 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE BIOMERIEUX (FR) 2010-11-04 US disclosed
EP-0382990-A1 Strains of bacillus thuringiensis PLANT GENETIC SYSTEMS, N.V. (BE) 1990-08-22 EP disclosed
US-4308348-A SALMONELLA, SERRATIA, PROTEUS, PROVIDENCIA LABORATOIRE DE RECHERCHE API (FR) 1981-12-29 US disclosed