SCHEMBL4284694

SCHEMBL4284694

COc1nc(C)nc(N(C(N)=O)S(=O)(=O)c2ccccc2C(=O)O)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.42
PRSS1 P07477 3/20 0.42
PRSS2 P07478 3/20 0.42
PRSS3 P35030 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
FABP4 P15090 4/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
HTT P42858 1/20 0.34
PKM P14618 1/20 0.34
CA9 Q16790 2/20 0.33
CA5A P35218 1/20 0.33
CA12 O43570 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL8848745 0.90 CA1 (0.46) F2PRSS1PRSS2PRSS3MEN1
SCHEMBL4291049 0.87 MEN1 (0.38) F2PRSS1PRSS2PRSS3MEN1
SCHEMBL10914176 0.85 MEN1 (0.56) MEN1KMT2AHTTPKMKDM4E
SCHEMBL187348 0.85 MEN1 (0.33) F2PRSS1PRSS2PRSS3MEN1
SCHEMBL8740196 0.85 KMT2A (0.43) F2MEN1KMT2APKMKDM4E
SCHEMBL9247098 0.85 ALDH1A1 (0.34) F2PRSS1PRSS2PRSS3MEN1
SCHEMBL2451964 0.81 LMNA (0.40) MEN1KMT2AFABP4CYP3A4TSHR
SCHEMBL4286897 0.81 F2 (0.43) F2PRSS1PRSS2PRSS3MEN1
SCHEMBL10683692 0.81 KMT2A (0.39) MEN1KMT2APKMKDM4ECYP1A2
SCHEMBL5484371 0.80 F2 (0.40) F2PRSS1PRSS2PRSS3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0987945-B1 NEW HERBICIDAL MIXTURES AVENTIS CROPSCIENCE SA (FR) 2001-10-24 EP claimed
US-6239070-B1 REDUCING PHYTOTOXICITY USING 4-BENZOYLISOXAZOLE HERBICIDE;MIXTURE CONTAINING PLANT SAFENING AGENT RHONE-POULENC INC. 2001-05-29 US claimed
EP-0987945-A1 NEW HERBICIDAL MIXTURES RHONE-POULENC AGROCHIMIE (FR) 2000-03-29 EP claimed
WO-1998056251-A1 NEW HERBICIDAL MIXTURES RHONE-POULENC AGRO (FR) 1998-12-17 WO claimed
EP-0619946-B1 Herbicidal composition for upland farming and weeding method NIHON NOHYAKU CO LTD (JP) 1996-06-05 EP claimed
EP-3752201-B1 SUSPENSION OF NANOSCALE, ORGANIC PARTICLES AND PROCESS FOR PRODUCTION THEREOF UNIV FRIEDRICH ALEXANDER ER (DE) 2023-11-22 EP disclosed
US-20230136215-A1 PRODUCTION OF DUNALIELLA UNIVERSITY OF GREENWICH (GB) 2023-05-04 US disclosed
EP-3752201-A1 SUSPENSION OF NANOSCALE, ORGANIC PARTICLES AND PROCESS FOR PRODUCTION THEREOF Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2020-12-23 EP disclosed
US-20200368302-A1 PRODUCTION OF DUNALIELLA UNIVERSITY OF GREENWICH (GB) 2020-11-26 US disclosed
WO-2019158509-A1 SUSPENSION OF NANOSCALE, ORGANIC PARTICLES AND PROCESS FOR PRODUCTION THEREOF Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2019-08-22 WO disclosed
US-20170042157-A1 HERBICIDE COMBINATIONS COMPRISING SPECIFIC SULFONYLUREAS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-02-16 US disclosed
US-8962004-B2 Encapsulated triazinyl sulfonylurea herbicide and methods of use ARYSTA LIFESCIENCE NORTH AMERICA, LLC (US) 2015-02-24 US disclosed
EP-0831707-A1 HERBICIDES WITH 4-IODO-2-[3-(4-METHOXY-6-METHYL-1,3,5-TRIAZIN-2-YL)UREIDOSULFONYL]-BENZOIC ACID ESTERS Hoechst Schering AgrEvo GmbH (DE) 1998-04-01 EP disclosed
EP-0648413-B1 Alkylsiloxanes as adjuvants for agriculture OSI SPECIALTIES INC (US) 1998-03-11 EP disclosed
US-5658852-A POLYSILOXANES OSI SPECIALTIES, INC. (US) 1997-08-19 US disclosed
WO-1996041537-A1 HERBICIDES WITH 4-IODO-2-[3-(4-METHOXY-6-METHYL-1,3,5-TRIAZIN-2-YL)UREIDOSULFONYL]-BENZOIC ACID ESTERS HOECHST SCHERING AGREVO GMBH (DE) 1996-12-27 WO disclosed
US-5561099-A OIL-BASED CHEMICALS OSI SPECIALTIES, INC. (US) 1996-10-01 US disclosed
EP-0648413-A1 Alkylsiloxanes as adjuvants for agriculture OSi Specialties, Inc. (US) 1995-04-19 EP disclosed
EP-0605533-A1 SYNERGISTIC HERBICIDAL COMPOSITIONS SCHERING AKTIENGESELLSCHAFT (DE) 1994-07-13 EP disclosed
WO-1993005655-A1 SYNERGISTIC HERBICIDAL COMPOSITIONS SCHERING AKTIENGESELLSCHAFT (DE) 1993-04-01 WO 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 (3 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-20170042157-A1 HERBICIDE COMBINATIONS COMPRISING SPECIFIC SULFONYLUREAS GSTM2, GSTM1, CHRM2 F2 2816/4885PRSS1 2749/4885PRSS2 1883/4885
US-20230136215-A1 PRODUCTION OF DUNALIELLA DDT, DLD, DAGLA F2 3324/4885PRSS1 3257/4885PRSS2 2549/4885
US-20200368302-A1 PRODUCTION OF DUNALIELLA DDT, DLD, DAGLA F2 3324/4885PRSS1 3257/4885PRSS2 2549/4885

“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.