SCHEMBL24874118

SCHEMBL24874118

CC(C)(O)C(C)(C)OBc1ccc(OC(F)F)c(Cl)c1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 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
SCHEMBL23692658 0.88 — —
SCHEMBL23693410 0.83 — —
SCHEMBL19299765 0.76 — —
SCHEMBL23693409 0.75 — —
SCHEMBL14824789 0.73 — —
SCHEMBL23692800 0.73 KDM4E (0.33) ALDH1A1MAPT
SCHEMBL23692657 0.72 ALDH1A1 (0.32) ALDH1A1
SCHEMBL23692791 0.71 — —
SCHEMBL23638849 0.69 PPARG (0.33) MEN1KMT2AALDH1A1
SCHEMBL24773785 0.69 — —

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
WO-2023280733-A1 QUATERNARY AMMONIUM CATION SUBSTITUTED COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-12 — — WO disclosed
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