SCHEMBL7011324

SCHEMBL7011324

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ 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

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
SCHEMBL7016251 0.83 KMT2A (0.41) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7018531 0.82 SMN1; SMN2 (0.50) L3MBTL1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL7012969 0.82 MEN1 (0.45) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7018535 0.82 MEN1 (0.40) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7011472 0.81 MEN1 (0.56) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7014110 0.80 MEN1 (0.43) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7013922 0.80 KMT2A (0.43) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7017825 0.80 MEN1 (0.45) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7019146 0.80 MEN1 (0.45) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL7016565 0.79 MEN1 (0.42) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2

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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