SCHEMBL5760754

SCHEMBL5760754

Cc1cc(OC(=O)NCc2ccccc2)c(=O)n(C2CCCCC2)c1C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NCEH1 Q6PIU2 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
EPHX1 P07099 1/20 0.41
HPGD P15428 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 2/20 0.40
AADAT Q8N5Z0 1/20 0.40
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
KMT2A Q03164 2/20 0.40
GPR55 Q9Y2T6 1/20 0.40
GAA P10253 2/20 0.39
MEN1 O00255 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL2736780 0.82 CNR1 (0.57) LMNAHTTSMN1; SMN2HRH3HPGD
SCHEMBL5760050 0.80 NCEH1 (0.47) SMN1; SMN2NCEH1HPGDALDH1A1CNR1
SCHEMBL2736774 0.74 CNR2 (0.54) SMN1; SMN2EPHX1NPC1RAB9AALDH1A1
SCHEMBL717950 0.67 HPGD (0.63) LMNANCEH1HPGDNPC1RAB9A
SCHEMBL2736554 0.67 CNR2 (0.64) HPGDNPC1RAB9AALDH1A1CNR1
SCHEMBL20169886 0.67 NCEH1 (0.56) SMN1; SMN2NCEH1HPGDNPC1RAB9A
SCHEMBL13342857 0.66 SMN1; SMN2 (0.53) LMNAHTTSMN1; SMN2NCEH1HPGD
SCHEMBL27630590 0.66 HDAC3 (0.62) SMN1; SMN2EPHX1HPGDNPC1RAB9A
SCHEMBL2834010 0.65 GAA (0.56) LMNASMN1; SMN2HPGDALDH1A1KMT2A
SCHEMBL27652150 0.65 HDAC3 (0.60) SMN1; SMN2EPHX1HPGDNPC1RAB9A

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-1562902-B1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2006-05-03 EP claimed