SCHEMBL7959833

SCHEMBL7959833

COCCOCOc1cc(C(ON)C(=O)OC(c2ccccc2)c2ccccc2)cc(F)c1OCOCCOC

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARG P13631 8/20 0.35
KIF11 P52732 1/20 0.33
RARA P10276 2/20 0.32
RARB P10826 1/20 0.32
IKBKB O14920 1/20 0.31
MAPK1 P28482 1/20 0.31
F2 P00734 1/20 0.30
ELANE P08246 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL8380382 0.87 RARG (0.36) RARGKIF11RARARARBIKBKB
SCHEMBL9065459 0.87 KIF11 (0.33) RARGKIF11RARARARBMAPK1
SCHEMBL9361830 0.85 RARG (0.36) RARGKIF11RARARARBF2
SCHEMBL9252923 0.79 RARG (0.32) RARGMAPK1NPC1RAB9A
SCHEMBL8550659 0.78 RARG (0.33) RARGKIF11MAPK1FFAR4NPC1
SCHEMBL8550666 0.77 HTT (0.34) RARGRARARARBIKBKBF2
SCHEMBL7962141 0.75 BLM (0.37) RARGRARARARBIKBKBF2
SCHEMBL8133892 0.75 RAB9A (0.33) RARGMAPK1NPC1RAB9A
SCHEMBL8377229 0.75 KIF11 (0.32) KIF11
SCHEMBL7965969 0.75 LMNA (0.30)

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
US-6313305-B1 ANTIBIOTICS, BACTERICIDES HOECHST MARION ROUSSEL (FR) 2001-11-06 US 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