SCHEMBL7764756

SCHEMBL7764756

[NH]C(=O)CN1CCCC1CO

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
POLB P06746 1/20 0.50
ALDH1A1 P00352 2/20 0.41
HRH3 Q9Y5N1 1/20 0.38
SPHK2 Q9NRA0 8/20 0.37
SPHK1 Q9NYA1 8/20 0.37
TERT O14746 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PNP P00491 1/20 0.33

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
SCHEMBL7764759 1.00 L3MBTL1 (0.50) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL7763371 0.82 POLB (0.52) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL2185067 0.81 L3MBTL1 (0.50) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL2155920 0.81 POLB (0.50) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL10002487 0.81 POLB (0.50) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL7764760 0.81 POLB (0.50) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL2185063 0.81 L3MBTL1 (0.50) L3MBTL1POLBALDH1A1HRH3SPHK2
Hydrochloric Acid SCHEMBL2674244 0.79 POLB (0.48) L3MBTL1POLBALDH1A1HRH3SPHK2
SCHEMBL6050349 0.78 KMT2A (0.48) L3MBTL1ALDH1A1TERTMEN1KMT2A
SCHEMBL9844232 0.78 POLB (0.47) L3MBTL1POLBALDH1A1HRH3SPHK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1102789-A1 MONOCYCLIC COMPOUNDS HAVING NK-2 ANTAGONIST ACTION AND COMPOSITIONS CONTAINING THEM Menarini Ricerche S.p.A. (IT) 2001-05-30 EP disclosed
WO-2000008046-A1 MONOCYCLIC COMPOUNDS HAVING NK-2 ANTAGONIST ACTION AND COMPOSITIONS CONTAINING THEM MENARINI RICERCHE S.P.A. (IT) 2000-02-17 WO disclosed