SCHEMBL14395035

SCHEMBL14395035

CCCCOc1ccc([C@@H]2CC(=O)N2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.64
LMNA P02545 3/20 0.58
CRBN Q96SW2 1/20 0.57
MAOA P21397 3/20 0.55
MAOB P27338 3/20 0.55
MAPT P10636 2/20 0.54
ALDH1A1 P00352 1/20 0.54
PKM P14618 1/20 0.51
POLB P06746 2/20 0.48
KMT2A Q03164 1/20 0.48
NPY1R P25929 1/20 0.47
NPY2R P49146 1/20 0.47
KDM4A O75164 1/20 0.44
USP2 O75604 1/20 0.44
ALOX15 P16050 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44

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
SCHEMBL7193200 0.80 MAPT (0.43) NPC1LMNACRBNMAOAMAOB
SCHEMBL14584671 0.78 NPC1 (0.47) NPC1LMNACRBNMAOAMAOB
SCHEMBL1443189 0.77 MAPT (0.53) NPC1LMNACRBNMAOAMAOB
SCHEMBL1443188 0.77 MAPT (0.53) NPC1LMNACRBNMAOAMAOB
SCHEMBL21556950 0.75 MAOA (0.49) NPC1LMNACRBNMAOAMAOB
SCHEMBL5207455 0.75 MAOB (0.56) LMNAMAOAMAOBMAPTPOLB
SCHEMBL6765500 0.74 NPC1 (0.56) NPC1LMNACRBNMAOAMAOB
SCHEMBL11588202 0.74 NPC1 (0.55) NPC1LMNACRBNMAOAMAOB
SCHEMBL29410461 0.74 ALDH1A1 (0.61) NPC1LMNACRBNMAOAMAOB
SCHEMBL7193198 0.73 TSHR (0.36) NPC1LMNACRBNMAPTALDH1A1

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
EP-1362855-B1 BETA-LACTAM COMPOUNDS, PROCESS FOR REPODUCING THE SAME AND SERUM CHOLESTEROL-LOWERING AGENTS CONTAINING THE SAME KOTOBUKI PHARMACEUTICAL CO LTD (JP) 2007-10-03 EP disclosed