SCHEMBL2615565

SCHEMBL2615565

C/C(=N/S(=O)(=O)C(F)(F)F)NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.43
PRSS1 P07477 2/20 0.43
PRSS2 P07478 2/20 0.43
PRSS3 P35030 2/20 0.43
CA12 O43570 4/20 0.34
CA14 Q9ULX7 4/20 0.34
CA1 P00915 3/20 0.34
CA7 P43166 2/20 0.34
CA2 P00918 2/20 0.34
APLNR P35414 1/20 0.31
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
NPC1 O15118 4/20 0.30
RAB9A P51151 4/20 0.30
SMN1; SMN2 Q16637 3/20 0.30
HTT P42858 2/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPT P10636 1/20 0.30
MEN1 O00255 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
SCHEMBL15893686 1.00 F2 (0.43) F2PRSS1PRSS2PRSS3CA12
SCHEMBL446590 0.85 F2 (0.44) F2PRSS1PRSS2PRSS3CA12
SCHEMBL2339827 0.82 F2 (0.50) F2PRSS1PRSS2PRSS3CA12
SCHEMBL2339824 0.82 F2 (0.50) F2PRSS1PRSS2PRSS3CA12
SCHEMBL17070555 0.81 CA1 (0.37) CA12CA14CA1CA7CA2
SCHEMBL2369616 0.80 F2 (0.40) F2PRSS1PRSS2PRSS3CA12
SCHEMBL2369612 0.80 F2 (0.40) F2PRSS1PRSS2PRSS3CA12
SCHEMBL16298358 0.80 F2 (0.40) F2PRSS1PRSS2PRSS3CA12
SCHEMBL14493144 0.78 F2 (0.39) F2PRSS1PRSS2PRSS3CA12
SCHEMBL24927874 0.75 F2 (0.36) F2PRSS1PRSS2PRSS3CA12

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11786539-B2 Aminoglycoside derivatives and uses thereof in treating genetic disorders ELOXX PHARMACEUTICALS LTD. (IL) 2023-10-17 US disclosed
US-20230241257-A1 BIOTIN-MODIFIED DIMER AND USE THEREOF THE UNIVERSITY OF TOKYO (JP) 2023-08-03 US disclosed
US-20180177812-A1 AMINOGLYCOSIDE DERIVATIVES AND USES THEREOF IN TREATING GENETIC DISORDERS ELOXX PHARMACEUTICALS LTD. (IL) 2018-06-28 US disclosed
US-20180066008-A1 MACROLIDES WITH MODIFIED DESOSAMINE SUGARS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-03-08 US disclosed
US-9889182-B2 Assisted enzyme replacement therapy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-02-13 US disclosed
US-9809621-B2 Stable peptide-based PACE4 inhibitors SOCPRA SCIENCES SANTÉ ET HUMAINES S.E.C. (CA) 2017-11-07 US disclosed
US-9724434-B2 Lysine oligomer derivative and cartilage tissue marker made thereof NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) 2017-08-08 US disclosed
US-20160137617-A1 NEW MACROCYCLIC AMIDINOUREA DERIVATIVES, METHODS OF PREPARATION AND USES THEREOF AS CHITINASE INHIBITORS CYGNET BIOSCIENCES B.V. 2016-05-19 US disclosed
US-9249275-B2 Polyionic dendrimer and hydrogel comprising same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2016-02-02 US disclosed
US-20150376145-A1 STABLE SODIUM CHANNEL BLOCKERS PARION SCIENCES, INC. (US) 2015-12-31 US disclosed
US-20140221292-A1 POLYIONIC DENDRIMER AND HYDROGEL COMPRISING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-08-07 US disclosed
US-20140206622-A1 STABLE PEPTIDE-BASED PACE4 INHIBITORS SOCPRA Sciences Sante et Humaines S.E.C. (CA) 2014-07-24 US disclosed
US-20140031371-A1 POLY AROMATIC SODIUM CHANNEL BLOCKERS PARION SCIENCES, INC. (US) 2014-01-30 US disclosed
US-8575176-B2 Heteroaromatic pyrazinoylguanidine sodium channel blockers PARION SCIENCES, INC. (US) 2013-11-05 US disclosed
US-20130184274-A1 Protein Kinase Inhibitors and Methods of Treatment THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2013-07-18 US disclosed
US-20120196933-A1 MEXILETINE PRODRUGS FRANKLIN RICHARD (GB) 2012-08-02 US disclosed
US-20120189601-A1 ASSISTED ENZYME REPLACEMENT THERAPY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-07-26 US disclosed
US-20120116083-A1 HETEROAROMATIC PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS PARION SCIENCES, INC. (US) 2012-05-10 US disclosed
US-20120101041-A1 POLYIONIC DENDRIMER AND HYDROGEL COMPRISING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-26 US disclosed
US-20120077863-A1 GUANIDINO-SUBSTITUTED BI-AND POLYPHENYLS AS SMALL MOLECULE CARRIERS UCL BUSINESS PLC (GB) 2012-03-29 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 (15 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-20180066008-A1 MACROLIDES WITH MODIFIED DESOSAMINE SUGARS AND USES THEREOF FUT6, MGAM, B3GNT2 F2 4827/4885PRSS1 565/4885PRSS2 682/4885
US-20180177812-A1 AMINOGLYCOSIDE DERIVATIVES AND USES THEREOF IN TREATING GENETIC DISORDERS UPF1, UGGT1, ARSA F2 4145/4885PRSS1 1427/4885PRSS2 1392/4885
US-20160137617-A1 NEW MACROCYCLIC AMIDINOUREA DERIVATIVES, METHODS OF PREPARATION AND USES THEREOF AS CHITINASE INHIBITORS CHIT1, CHIA, ENGASE F2 828/4885PRSS1 426/4885PRSS2 365/4885
US-11786539-B2 Aminoglycoside derivatives and uses thereof in treating genetic disorders UPF1, UGGT1, ARSA F2 4145/4885PRSS1 1427/4885PRSS2 1392/4885
US-20120196933-A1 MEXILETINE PRODRUGS SLC16A1, MTPN, SLC16A3 F2 4772/4885PRSS1 1325/4885PRSS2 2689/4885
US-20130184274-A1 Protein Kinase Inhibitors and Methods of Treatment PRKDC, PRKACA, PRKX F2 3237/4885PRSS1 1865/4885PRSS2 2260/4885
US-20140221292-A1 POLYIONIC DENDRIMER AND HYDROGEL COMPRISING SAME CD44, PCNA, GMNN F2 3709/4885PRSS1 4742/4885PRSS2 4183/4885
US-20120189601-A1 ASSISTED ENZYME REPLACEMENT THERAPY GAA, GLA, ENPEP F2 1506/4885PRSS1 221/4885PRSS2 192/4885
US-20120101041-A1 POLYIONIC DENDRIMER AND HYDROGEL COMPRISING SAME CD44, PCNA, GMNN F2 3709/4885PRSS1 4742/4885PRSS2 4183/4885
US-20140206622-A1 STABLE PEPTIDE-BASED PACE4 INHIBITORS FURIN, DNPEP, PRAP1 F2 4100/4885PRSS1 100/4885PRSS2 261/4885
US-20230241257-A1 BIOTIN-MODIFIED DIMER AND USE THEREOF BTD, HLCS, BRD4 F2 23/4885PRSS1 1991/4885PRSS2 2024/4885
US-20120116083-A1 HETEROAROMATIC PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS HCN4, SCN2B, KCNH1 F2 4510/4885PRSS1 1437/4885PRSS2 1692/4885
US-20150376145-A1 STABLE SODIUM CHANNEL BLOCKERS SCN1B, SCN2B, CACNA1B F2 3214/4885PRSS1 2178/4885PRSS2 2339/4885
US-20140031371-A1 POLY AROMATIC SODIUM CHANNEL BLOCKERS HCN4, SCN2B, SCNN1B F2 4085/4885PRSS1 1506/4885PRSS2 1875/4885
US-20120077863-A1 GUANIDINO-SUBSTITUTED BI-AND POLYPHENYLS AS SMALL MOLECULE CARRIERS CFTR, GNB1, GMPS F2 794/4885PRSS1 1267/4885PRSS2 1830/4885

“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.