SCHEMBL7790107

SCHEMBL7790107

COCCOCOc1c(Cl)cc(C=O)c(Cl)c1OCOCCOC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 3/20 0.36
ALDH1A1 P00352 6/20 0.34
TDP1 Q9NUW8 3/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
POLB P06746 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34
RECQL P46063 1/20 0.34
CYP1A2 P05177 3/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ORAI1 Q96D31 1/20 0.32
LMNA P02545 1/20 0.31
KDM4E B2RXH2 2/20 0.30
CTNNB1 P35222 1/20 0.30

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
SCHEMBL7966411 0.86 ALDH1A1 (0.39) ALDH1A1TDP1MAPTHPGDMEN1
SCHEMBL7962499 0.82 ALDH1A1 (0.35) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL7951953 0.82 ALDH1A1 (0.34) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL9672501 0.81 ALDH1A1 (0.44) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL8336632 0.81 ALDH1A1 (0.38) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL7961321 0.79 ALDH1A1 (0.36) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL7951853 0.77 ALDH1A1 (0.50) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL7963270 0.77 ALDH1A1 (0.51) RARGALDH1A1TDP1MAPTHPGD
SCHEMBL25231200 0.75 EGFR (0.37) RARGALDH1A1L3MBTL1POLBLMNA
SCHEMBL30407021 0.75 EGFR (0.37) RARGALDH1A1L3MBTL1POLBLMNA

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
EP-0761672-B1 Cephalosporins containing in position 7 a substituted benzyloxyimino radical, processes for their preparation and intermediates for their preparation, their use as medicaments AVENTIS PHARMA SA (FR) 2001-11-07 EP disclosed
US-6313305-B1 ANTIBIOTICS, BACTERICIDES HOECHST MARION ROUSSEL (FR) 2001-11-06 US disclosed
EP-0551034-B1 Antibiotic cephalosporins having in position 7 a substituted benzyloxyimino radical HOECHST MARION ROUSSEL INC (FR) 2000-09-20 EP disclosed
EP-1016646-A1 Intermediates for the preparation of cephalosporines containing on the 7-position a substituted benzyloximino radical HOECHST MARION ROUSSEL (FR) 2000-07-05 EP disclosed
EP-0761672-A1 Cephalosporin containing in position 7 a substituted benzyloxyimino radical, processes for their preparation and intermediates for their preparation, their use as medicaments ROUSSEL UCLAF (FR) 1997-03-12 EP disclosed
US-5587372-A BACERICIDES ROUSSEL UCLAF (FR) 1996-12-24 US disclosed
US-5455238-A Bactericides ROUSSEL UCLAF (FR) 1995-10-03 US disclosed
EP-0551034-A2 Cephalosporins having in position 7 a benzyloxyimino radical substitute, process for their preparation and their use as medicaments ROUSSEL UCLAF (FR) 1993-07-14 EP disclosed