SCHEMBL7016565

SCHEMBL7016565

C=CCOC(=O)Nc1c[c]cc(SC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ GAA P10253 1/20 0.37
▸ TUBB4A P04350 1/20 0.36
▸ TUBB P07437 1/20 0.36
▸ TUBA3C P0DPH7 1/20 0.36
▸ TUBA1B P68363 1/20 0.36
▸ TUBA4A P68366 1/20 0.36
▸ TUBB4B P68371 1/20 0.36
▸ TUBB3 Q13509 1/20 0.36
▸ TUBB2A Q13885 1/20 0.36
▸ TUBB8 Q3ZCM7 1/20 0.36
▸ TUBA3E Q6PEY2 1/20 0.36
▸ TUBA1A Q71U36 1/20 0.36
▸ TUBA1C Q9BQE3 1/20 0.36
▸ TUBB6 Q9BUF5 1/20 0.36
▸ TUBB2B Q9BVA1 1/20 0.36
▸ TUBB1 Q9H4B7 1/20 0.36
▸ AGPAT2 O15120 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36

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
SCHEMBL7012969 0.82 MEN1 (0.45) MEN1KMT2ATUBB4ATUBBTUBA3C
SCHEMBL7011472 0.81 MEN1 (0.56) MEN1KMT2ATUBB4ATUBBTUBA3C
SCHEMBL7013922 0.80 KMT2A (0.43) MEN1KMT2AGAATUBB4ATUBB
SCHEMBL7014110 0.80 MEN1 (0.43) MEN1KMT2ATUBB4ATUBBTUBA3C
SCHEMBL7019146 0.80 MEN1 (0.45) MEN1KMT2ATUBB4ATUBBTUBA3C
SCHEMBL7017825 0.80 MEN1 (0.45) MEN1KMT2ATUBB4ATUBBTUBA3C
SCHEMBL7011324 0.79 MEN1 (0.42) MEN1KMT2ATUBB4ATUBBTUBA3C
SCHEMBL7017831 0.79 NPC1 (0.48) MEN1KMT2AGAATUBB4ATUBB
SCHEMBL7012800 0.79 KMT2A (0.42) MEN1KMT2AGAATUBB4ATUBB
SCHEMBL7020642 0.78 MEN1 (0.44) MEN1KMT2ATUBB4ATUBBTUBA3C

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0889034-B1 AMINOPYRIDINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-09-17 — — EP disclosed
US-6011039-A USEFUL AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS; TREATING HYPERPHAGIA, OBESITY OR DIABETES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-01-04 — — US disclosed
EP-0889034-A1 AMINOPYRIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-01-07 — — EP disclosed
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