SCHEMBL2563563

SCHEMBL2563563

NC(=O)C1CCCCN1CC[O]

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
KCNK3 O14649 1/20 0.38
POLB P06746 2/20 0.36
SPHK1 Q9NYA1 1/20 0.36
SMN1; SMN2 Q16637 5/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
KCNH2 Q12809 1/20 0.35
TSHR P16473 1/20 0.35
SCN3A Q9NY46 1/20 0.34
KDM4E B2RXH2 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
SLC6A1 P30531 1/20 0.33
HTT P42858 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
SCHEMBL5216730 0.94 POLB (0.40) LMNAKCNK3POLBSPHK1SMN1; SMN2
SCHEMBL3276055 0.94 POLB (0.40) LMNAKCNK3POLBSPHK1SMN1; SMN2
SCHEMBL3388069 0.85 HTT (0.44) LMNAKCNK3POLBSPHK1SMN1; SMN2
SCHEMBL25833199 0.85 HTT (0.44) LMNAKCNK3POLBSPHK1SMN1; SMN2
SCHEMBL1467828 0.84 NR1I2 (0.39) LMNAPOLBSPHK1SMN1; SMN2CYP3A4
SCHEMBL3969870 0.84 LMNA (0.52) LMNAKCNK3POLBSPHK1SMN1; SMN2
SCHEMBL16106743 0.84 NR1I2 (0.39) LMNAPOLBSPHK1SMN1; SMN2CYP3A4
SCHEMBL20143218 0.84 LMNA (0.52) LMNAKCNK3POLBSPHK1SMN1; SMN2
SCHEMBL20838273 0.82 POLB (0.39) LMNAKCNK3POLBSPHK1SMN1; SMN2
Hydrochloric Acid SCHEMBL28153235 0.82 LMNA (0.51) LMNAKCNK3POLBSPHK1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2069354-B1 Aza-benzofuranyl compounds and methods of use GENENTECH INC (US) 2011-11-02 EP claimed