SCHEMBL17180752

SCHEMBL17180752

O=C(O)Oc1cc(-c2nc(-c3ccc(Cl)c(Cl)c3)cs2)ccc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EIF4E P06730 18/20 0.74
▸ KDM4E B2RXH2 2/20 0.58
▸ NPC1 O15118 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ CRHBP P24387 1/20 0.58
▸ CRHR2 Q13324 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56

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
SCHEMBL17180816 0.94 EIF4E (0.74) EIF4E
SCHEMBL17180823 0.92 EIF4E (0.72) EIF4EKDM4ENPC1RAB9AMEN1
SCHEMBL17180817 0.91 EIF4E (0.75) EIF4E
SCHEMBL17180824 0.90 EIF4E (0.59) EIF4EKDM4ENPC1RAB9AMEN1
SCHEMBL17180768 0.90 EIF4E (0.74) EIF4E
SCHEMBL17180786 0.90 EIF4E (0.74) EIF4E
SCHEMBL17180796 0.90 EIF4E (0.74) EIF4E
SCHEMBL17180788 0.88 EIF4E (0.77) EIF4E
SCHEMBL17180783 0.88 EIF4E (0.77) EIF4E
SCHEMBL17180736 0.87 EIF4E (0.72) EIF4EKDM4ENPC1RAB9AMEN1

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-2758380-B1 BENZOIC ACID DERIVATIVES AS EIF4E INHIBITORS HOFFMANN LA ROCHE (CH) 2015-10-21 — — EP claimed
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