SCHEMBL8096686

SCHEMBL8096686

Bc1ccccc1S(=O)(=O)/N=C/N(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
BCAT1 P54687 1/20 0.39
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.32
HTR6 P50406 1/20 0.32
HTT P42858 2/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL10530946 0.79 LMNA (0.49) LMNAGAABCAT1ALDH1A1POLB
SCHEMBL489291 0.79 LMNA (0.49) LMNAGAABCAT1ALDH1A1POLB
SCHEMBL29816630 0.79 LMNA (0.49) LMNAGAABCAT1ALDH1A1KMT2A
SCHEMBL7534421 0.74 GAA (0.44) LMNAGAABCAT1ALDH1A1KDM4E
SCHEMBL7534420 0.74 GAA (0.44) LMNAGAABCAT1ALDH1A1KDM4E
SCHEMBL4972178 0.74 LMNA (0.70) LMNAGAABCAT1ALDH1A1KDM4E
SCHEMBL4110091 0.74 LMNA (0.70) LMNAGAABCAT1ALDH1A1KDM4E
SCHEMBL6229583 0.73 LMNA (0.54) LMNAGAABCAT1ALDH1A1POLB
SCHEMBL6229585 0.73 LMNA (0.54) LMNAGAABCAT1ALDH1A1POLB
SCHEMBL7262048 0.73 GAA (0.67) LMNAGAABCAT1ALDH1A1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008153857-A1 DUAL-ACTING BENZOIMIDAZOLE ANTIHYPERTENSIVE AGENTS THERAVANCE, INC. (US) 2008-12-18 WO disclosed
WO-2008133896-A2 DUAL-ACTING ANTIHYPERTENSIVE AGENTS THERAVANCE, INC. (US) 2008-11-06 WO disclosed