SCHEMBL11065100

SCHEMBL11065100

CCCCCCCc1ncc(NC(N)=S)c(OC)n1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
PABPC1 P11940 1/20 0.35
KMT2A Q03164 1/20 0.35
XDH P47989 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
SPHK1 Q9NYA1 4/20 0.30
ALOX5 P09917 1/20 0.30
MPEG1 Q2M385 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
SCHEMBL11065726 0.90 XDH (0.37) MEN1KMT2AXDH
SCHEMBL11061474 0.78 L3MBTL1 (0.34) MEN1PABPC1KMT2AL3MBTL1
SCHEMBL11060716 0.76 MEN1 (0.36) MEN1PABPC1KMT2AXDH
SCHEMBL11058685 0.74 L3MBTL1 (0.40) MEN1KMT2AL3MBTL1
SCHEMBL10959341 0.74 L3MBTL1 (0.37) MEN1KMT2AL3MBTL1
SCHEMBL11065739 0.72 ALDH1A1 (0.33) L3MBTL1
SCHEMBL11062622 0.72 CDK1 (0.33) MEN1KMT2AXDH
SCHEMBL11062388 0.71
SCHEMBL11065105 0.71 MEN1 (0.31) MEN1KMT2AALOX5
SCHEMBL11060997 0.69 MEN1 (0.36) MEN1KMT2AL3MBTL1

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-4434167-A Pyrimidyl thioureas useful for the treatment of hypertension and hyperlipidemia BEIERSDORF AKTIENGESELLSCHAFT (DE) 1984-02-28 US disclosed