SCHEMBL14748474

SCHEMBL14748474

CCN(CC)S(=O)(=O)c1ccc(Oc2ccc3c(c2)COB3)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.62
LMNA P02545 4/20 0.62
HTT P42858 4/20 0.62
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
PDE4A P27815 1/20 0.60
PDE4B Q07343 1/20 0.60
PDE4C Q08493 1/20 0.60
PDE4D Q08499 1/20 0.60
ALDH1A1 P00352 3/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
MAPT P10636 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
SCHEMBL1474346 0.79 SMN1; SMN2 (1.00) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL14748434 0.75 PDE4A (0.50) SMN1; SMN2HTTPDE4APDE4BPDE4C
SCHEMBL2530543 0.75 PDE4B (1.00) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL5801556 0.73 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL11182312 0.73 LMNA (1.00) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL10945587 0.73 LMNA (0.86) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL8007552 0.72 PDE4A (0.50) SMN1; SMN2LMNAPDE4APDE4BPDE4C
SCHEMBL8007094 0.72 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DMAOA
SCHEMBL19622266 0.72 ALDH1A1 (0.47) SMN1; SMN2LMNANPC1RAB9APDE4A
SCHEMBL8010793 0.72 ST14 (0.51) MAOB

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-2564857-A1 Boron-containing small molecules as anti-inflammatory agents Anacor Pharmaceuticals, Inc. (US) 2013-03-06 EP disclosed