SCHEMBL8129787

SCHEMBL8129787

COCCOCOc1cc([O])cc(F)c1OCOCCOC

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARG P13631 2/20 0.35
F2 P00734 1/20 0.32
ELANE P08246 1/20 0.32
RARA P10276 2/20 0.31
RARB P10826 1/20 0.31
CTNNB1 P35222 1/20 0.31
IKBKB O14920 1/20 0.31
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 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
SCHEMBL8134003 0.83 RARG (0.38) RARGF2ELANERARARARB
SCHEMBL7959829 0.81 ALDH1A1 (0.40) RARGRARAIKBKB
SCHEMBL8134797 0.78 HPGD (0.36) F2ELANE
SCHEMBL8747650 0.78 F2 (0.39) RARGF2ELANERARARARB
SCHEMBL8118651 0.78 STING1 (0.44) RARGF2ELANERARARARB
SCHEMBL8747666 0.77 RARG (0.31) RARG
SCHEMBL8119132 0.76 STING1 (0.35) RARGF2ELANERARARARB
SCHEMBL8119126 0.76 RARG (0.35) RARGF2ELANERARARARB
SCHEMBL7962141 0.76 BLM (0.37) RARGF2ELANERARARARB
SCHEMBL7961925 0.75 ALDH1A1 (0.33) RARGF2ELANERARAIKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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