SCHEMBL8389974

SCHEMBL8389974

CCN(C(=O)C(C)c1ccc(C)c(N=S(=O)=O)c1)C(=S)NC

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 2/20 0.31
▸ ACHE P22303 2/20 0.31
▸ AKR1C3 P42330 2/20 0.30
▸ AKR1C2 P52895 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL8336199 0.92 BCHE (0.30) BCHEACHE
SCHEMBL8339687 0.90 — —
SCHEMBL8340757 0.89 — —
SCHEMBL8340257 0.88 PTGS2 (0.30) —
SCHEMBL8389243 0.88 PTGS2 (0.30) —
SCHEMBL8392720 0.88 PTGS2 (0.30) —
SCHEMBL8334767 0.86 ALDH1A1 (0.33) LMNAKMT2A
SCHEMBL8334478 0.85 BCHE (0.30) BCHEACHE
SCHEMBL8339418 0.85 BCHE (0.32) BCHEACHE
SCHEMBL8333965 0.85 BCHE (0.32) BCHEACHE

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
US-5880155-A TREATMENT OF CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-09 — — US disclosed
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