SCHEMBL8501876

SCHEMBL8501876

CCC(=O)c1cnc2c(OCC(C)=S)cccc2c1Cl

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL9267427 0.84 MEN1 (0.51) MEN1KMT2A
SCHEMBL8187701 0.81 MEN1 (0.42) MEN1KMT2A
SCHEMBL8177897 0.80 MEN1 (0.42) MEN1KMT2A
SCHEMBL8187622 0.79 MEN1 (0.43) MEN1KMT2A
SCHEMBL8504201 0.78 MEN1 (0.39) MEN1KMT2A
SCHEMBL8187555 0.78 MEN1 (0.43) MEN1KMT2A
SCHEMBL9272003 0.77 MEN1 (0.47) MEN1KMT2A
SCHEMBL10498626 0.76 ATP4A (0.47) MEN1KMT2A
SCHEMBL774957 0.76 ATP4A (0.61) —
SCHEMBL11244456 0.73 MEN1 (0.68) MEN1KMT2A

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-5889021-A GASTROINTESTINAL DISORDERS; ANTISECRETORY AGENTS; ANTIINFLAMMATORY AGENTS ASTRA AKTIEBOLAG (SE) 1999-03-30 — — US disclosed
Send feedback