SCHEMBL7960031

SCHEMBL7960031

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

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RARG P13631 3/20 0.33
FFAR4 Q5NUL3 2/20 0.33
FFAR1 O14842 1/20 0.33
CTNNB1 P35222 1/20 0.32
F2 P00734 1/20 0.30
ELANE P08246 1/20 0.30
RARA P10276 1/20 0.30
RARB P10826 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
SCHEMBL7962058 0.84 RARG (0.34) RARGFFAR4FFAR1CTNNB1F2
SCHEMBL8550659 0.83 RARG (0.33) RARGFFAR4
SCHEMBL7962141 0.81 BLM (0.37) RARGFFAR4FFAR1F2ELANE
SCHEMBL9252923 0.74 RARG (0.32) RARG
SCHEMBL9065459 0.74 KIF11 (0.33) RARGRARARARB
SCHEMBL7951484 0.73 FABP4 (0.50) RARGF2ELANERARARARB
SCHEMBL7962776 0.72 FABP4 (0.38) RARGF2ELANERARARARB
SCHEMBL8747650 0.71 F2 (0.39) RARGFFAR4FFAR1F2ELANE
SCHEMBL7965975 0.71 RARG (0.34) RARGCTNNB1F2ELANERARA
SCHEMBL8677572 0.71 MAPK1 (0.33) RARGFFAR4

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

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