SCHEMBL20116922

SCHEMBL20116922

C=CC(F)(Oc1cc(F)c(C(F)(F)F)c(F)c1)c1c(F)cc(CCCCCCCCCc2cc(F)c(C(F)(F)Oc3cc(F)c(C(F)(F)F)c(F)c3)c(F)c2)cc1F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.33

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
SCHEMBL15605821 0.89 DAO (0.39) DAO
SCHEMBL20115925 0.89 DAO (0.39) DAO
SCHEMBL16922742 0.83 DAO (0.35) DAO
SCHEMBL16922718 0.83 DAO (0.35) DAO
SCHEMBL15317532 0.81 PTGS2 (0.37) DAO
SCHEMBL7734949 0.81 PTGS2 (0.37) DAO
SCHEMBL20116924 0.80
SCHEMBL7730038 0.80 DAO (0.37) DAO
SCHEMBL13002579 0.80 DAO (0.37) DAO
SCHEMBL14226643 0.77 RARB (0.35) DAO

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
EP-2870218-B1 BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA MERCK PATENT GMBH (DE) 2018-05-02 EP disclosed