SCHEMBL28075994

SCHEMBL28075994

O=C(O)c1ccc(-c2ccc(-c3nc(-c4ccc(Cl)c(Cl)c4)cs3)cc2C(=O)O)cc1

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 19/20 0.85
KDM4E B2RXH2 1/20 0.80
MEN1 O00255 1/20 0.80
NPC1 O15118 1/20 0.80
RAB9A P51151 1/20 0.80
KMT2A Q03164 1/20 0.80

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
SCHEMBL14797242 0.92 EIF4E (1.00) EIF4E
SCHEMBL28830369 0.92 EIF4E (0.88) EIF4E
SCHEMBL14797054 0.92 EIF4E (1.00) EIF4E
SCHEMBL14797243 0.92 EIF4E (1.00) EIF4E
SCHEMBL14797375 0.91 EIF4E (1.00) EIF4E
SCHEMBL14797230 0.90 EIF4E (1.00) EIF4E
SCHEMBL14797195 0.90 EIF4E (1.00) EIF4E
SCHEMBL14797025 0.90 EIF4E (1.00) EIF4E
SCHEMBL14820513 0.90 EIF4E (0.88) EIF4E
SCHEMBL14797048 0.89 EIF4E (0.73) EIF4EKDM4EMEN1NPC1RAB9A

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
CN-103958487-B Benzoic acid derivative as EIF4E inhibitor 霍夫曼-拉罗奇有限公司 2016-07-13 CN disclosed