SCHEMBL24310804

SCHEMBL24310804

Cc1cccc(SNc2nc(Oc3ccccc3F)cc(-c3ccccc3C(C)C)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ USP1 O94782 2/20 0.34
▸ WDR48 Q8TAF3 2/20 0.34
▸ BRD4 O60885 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX5AP P20292 1/20 0.30
▸ FEN1 P39748 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
SCHEMBL24310613 0.92 LMNA (0.43) LMNAHTTUSP1WDR48BRD4
SCHEMBL24310227 0.90 HTT (0.36) LMNAHTTBRD4
SCHEMBL24310084 0.89 LMNA (0.36) LMNAHTTMAPT
SCHEMBL24310141 0.88 LMNA (0.35) LMNAHTT
SCHEMBL24310231 0.88 LMNA (0.35) LMNAHTT
SCHEMBL24310109 0.87 LMNA (0.38) LMNAHTTBRD4ALOX5APFEN1
SCHEMBL24310216 0.87 LMNA (0.38) LMNAHTTBRD4ALOX5APFEN1
SCHEMBL24310181 0.86 LMNA (0.37) LMNAHTTMAPT
SCHEMBL24309672 0.83 HTT (0.38) LMNAHTTMAPTALOX5APFEN1
SCHEMBL24309661 0.82 LMNA (0.37) LMNAHTTBRD4ALOX5APFEN1

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-2022076627-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 — — WO disclosed
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