SCHEMBL7466710

SCHEMBL7466710

CC1COCC(C)N1CCN1CCCCC1C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
LMNA P02545 2/20 0.34
KCNK3 O14649 1/20 0.34
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KCNH2 Q12809 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
F2 P00734 1/20 0.31
HTR4 Q13639 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CNR1 P21554 2/20 0.31
CNR2 P34972 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31
SPHK1 Q9NYA1 1/20 0.31

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
SCHEMBL7462298 0.87 SCN1A (0.38) POLBLMNAKCNK3SCN1ASCN2A
SCHEMBL7462283 0.87 SCN1A (0.38) POLBLMNAKCNK3SCN1ASCN2A
SCHEMBL7464291 0.84 LMNA (0.34) POLBLMNAKCNK3SCN1ASCN2A
SCHEMBL7464282 0.84 LMNA (0.34) POLBLMNAKCNK3SCN1ASCN2A
SCHEMBL7465346 0.84 LMNA (0.34) POLBLMNAKCNK3SCN1ASCN2A
SCHEMBL7465335 0.84 LMNA (0.34) POLBLMNAKCNK3SCN1ASCN2A
SCHEMBL7462375 0.79 SCN1A (0.41) POLBSCN1ASCN2ASCN3AKCNH2
SCHEMBL7462371 0.79 SCN1A (0.41) POLBSCN1ASCN2ASCN3AKCNH2
SCHEMBL3969870 0.76 LMNA (0.52) POLBLMNAKCNK3KCNH2SMN1; SMN2
SCHEMBL20143218 0.76 LMNA (0.52) POLBLMNAKCNK3KCNH2SMN1; 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-1098894-B1 FKBP INHIBITORS PFIZER LTD (GB) 2002-10-02 EP disclosed