SCHEMBL10141350

SCHEMBL10141350

C=C(Cc1ccc(S(=O)(=O)N2CCCC2)cc1)OC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
HTT P42858 1/20 0.54
KMT2A Q03164 5/20 0.53
ALDH1A1 P00352 6/20 0.53
USP2 O75604 2/20 0.53
MEN1 O00255 3/20 0.52
MAPT P10636 2/20 0.52
AGTR1 P30556 1/20 0.52
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL623009 0.84 AGTR1 (0.62) GLATDP1HTTKMT2AALDH1A1
SCHEMBL184604 0.83 AGTR1 (0.64) GLATDP1HTTKMT2AALDH1A1
SCHEMBL11148867 0.78 TDP1 (0.66) GLATDP1HTTKMT2AALDH1A1
SCHEMBL2517123 0.77 MEN1 (0.62) TDP1KMT2AALDH1A1USP2MEN1
SCHEMBL2517602 0.76 ALDH1A1 (0.67) TDP1ALDH1A1MAPTAGTR1KDM4E
SCHEMBL1422197 0.76 USP2 (0.65) GLATDP1HTTKMT2AALDH1A1
SCHEMBL3000302 0.76 USP2 (0.59) TDP1KMT2AALDH1A1USP2MEN1
SCHEMBL12646347 0.75 USP2 (0.68) TDP1HTTKMT2AALDH1A1USP2
SCHEMBL3568101 0.75 USP2 (0.68) TDP1KMT2AALDH1A1USP2MEN1
SCHEMBL5453322 0.74 MEN1 (0.58) TDP1HTTKMT2AALDH1A1USP2

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
WO-2012020357-A1 ACETAMIDE COMPOUNDS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION ADVINUS THERAPEUTICS LTD. (IN) 2012-02-16 WO disclosed