SCHEMBL2981001

SCHEMBL2981001

Cc1ccc(S(=O)(=O)Oc2c(Br)ccc3cccnc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.56
LMNA P02545 5/20 0.56
MAPT P10636 5/20 0.56
ALDH1A1 P00352 3/20 0.56
HTT P42858 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
KDM4E B2RXH2 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
KMT2A Q03164 7/20 0.48
CKS1B P61024 2/20 0.48
SKP2 Q13309 2/20 0.48
AGTR1 P30556 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
SLC40A1 Q9NP59 2/20 0.48
MITF O75030 1/20 0.48
S1PR4 O95977 1/20 0.48
S1PR1 P21453 1/20 0.48
OPRK1 P41145 1/20 0.48
METAP2 P50579 1/20 0.48
METAP1 P53582 1/20 0.48

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
SCHEMBL13977548 0.81 TDP1 (0.52) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL6268320 0.81 SLC40A1 (0.49) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL3263766 0.79 METAP2 (0.76) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL27862896 0.76 TDP1 (0.48) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL18263184 0.76 ALDH1A1 (0.51) LMNAMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL18318080 0.75 PDE4A (0.45) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL18419283 0.74 METAP2 (0.69) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL14820518 0.74 MEN1 (0.50) LMNAMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL8881578 0.73 KMT2A (0.54) TDP1LMNAMAPTALDH1A1HTT
SCHEMBL4539236 0.73 LMNA (0.52) TDP1LMNAMAPTHTTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781589-B2 Quantitative method of determining beryllium or a compound thereof in a sample LOS ALAMOS NATIONAL SECURITY, LLC (US) 2010-08-24 US disclosed
US-20070141715-A1 Quantitative method of determining beryllium or a compound thereof in a sample LOS ALAMOS NATIONAL SECURITY, LLC 2007-06-21 US disclosed
US-7129093-B2 Quantitative method of determining beryllium or a compound thereof in a sample LOS ALAMOS NATIONAL SECURITY, LLC (US) 2006-10-31 US disclosed
US-20050221498-A1 Quantitative method of determining beryllium or a compound thereof in a sample LOS ALAMOS NATIONAL SECURITY, LLC 2005-10-06 US disclosed