SCHEMBL16489290

SCHEMBL16489290

N=C(N)c1ccc(CS(=O)(=O)CC(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 5/20 0.51
PRSS2 P07478 4/20 0.51
PRSS3 P35030 4/20 0.51
F2 P00734 4/20 0.51
PLG P00747 1/20 0.51
C1S P09871 1/20 0.51
F10 P00742 2/20 0.47
LOXL2 Q9Y4K0 1/20 0.47
ITGB3 P05106 4/20 0.47
ITGA2B P08514 4/20 0.47
ST14 Q9Y5Y6 2/20 0.44
TMPRSS6 Q8IU80 4/20 0.43
TMPRSS15 P98073 1/20 0.42
KMT2A Q03164 1/20 0.41
NQO2 P16083 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL16489292 0.85 PRSS1 (0.46) PRSS1PRSS2PRSS3F2PLG
SCHEMBL3237371 0.82 TSHR (0.56) KMT2AALDH1A1
SCHEMBL8409513 0.78 KMT2A (0.48) PRSS1PRSS2PRSS3F2PLG
SCHEMBL15289189 0.77 PRSS1 (0.55) PRSS1PRSS2PRSS3F2PLG
SCHEMBL2338220 0.77 CA2 (0.52) KMT2AKDM4EALDH1A1
SCHEMBL11547040 0.77 F10 (0.61) PRSS1PRSS2PRSS3F2PLG
SCHEMBL8556017 0.77 TSHR (0.58) PRSS1PRSS2PRSS3F2PLG
SCHEMBL498617 0.76 ALDH1A1 (0.56) PRSS1PRSS2PRSS3KDM4EALDH1A1
SCHEMBL2337040 0.75 KMT2A (0.46) KMT2AALDH1A1
SCHEMBL1137128 0.75 LMNA (0.47) KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9266828-B2 Inhibitors of Furin and other pro-protein convertases SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2016-02-23 US disclosed
US-20150073054-A1 INHIBITORS OF FURIN AND OTHER PRO-PROTEIN CONVERTASES SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2015-03-12 US disclosed
US-20150051138-A1 INHIBITORS OF FURIN AND OTHER PRO-PROTEIN CONVERTASES SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-02-19 US disclosed

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

For each of this compound's patents that has machine-readable text (2 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-20150051138-A1 INHIBITORS OF FURIN AND OTHER PRO-PROTEIN CONVERTASES FURIN, PREP, PCSK6 PRSS1 16/4885PRSS2 43/4885PRSS3 64/4885
US-20150073054-A1 INHIBITORS OF FURIN AND OTHER PRO-PROTEIN CONVERTASES FURIN, PREP, PCSK6 PRSS1 16/4885PRSS2 43/4885PRSS3 64/4885

“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.