SCHEMBL16893908

SCHEMBL16893908

O=C(O)NS(=O)(=O)c1sccc1Br

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 7/20 0.35
LMNA P02545 1/20 0.34
EDNRB P24530 5/20 0.34
POLB P06746 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
CA12 O43570 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL8229612 0.81 CA1 (0.45) EDNRAEDNRBPOLBCA1CA2
SCHEMBL13268403 0.77 KMT2A (0.32) POLBKMT2AMEN1
SCHEMBL10754837 0.76 ALOX15 (0.40) CA1CA2CA12CA7CA9
SCHEMBL1926558 0.73 LMNA (0.34) EDNRALMNAEDNRBPOLBKMT2A
SCHEMBL8645010 0.73 SMN1; SMN2 (0.40) EDNRALMNAEDNRBPOLBKMT2A
SCHEMBL3059991 0.72 POLB (0.34) LMNAPOLBCA1CA2MMP1
SCHEMBL8087634 0.72 MMP2 (0.38) POLBCA1CA2MMP1MMP2
SCHEMBL1927671 0.72 CA2 (0.41) POLBCA1CA2CA12CA7
SCHEMBL16295622 0.71 KDM4E (0.37) EDNRAEDNRBKMT2ACCR4ACLY
Hydrochloric Acid SCHEMBL28079593 0.71 POLB (0.33) POLBCA1CA2CA12CA7

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
US-20150197502-A1 Bis-Acylated Hydroxylamine Derivatives THE JOHNS HOPKINS UNIVERSITY 2015-07-16 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150197502-A1 Bis-Acylated Hydroxylamine Derivatives CPT1A, TNNI3, NOS2 EDNRA 205/4885LMNA 1028/4885EDNRB 304/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.