SCHEMBL188762

SCHEMBL188762

[NH]S(=O)(=O)Oc1ccco1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP12 P39900 1/20 0.35
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.31
CA1 P00915 1/20 0.30
CA9 Q16790 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
SCHEMBL11066364 0.82 MMP1 (0.37) MMP1MMP9MMP12CES2CES1
SCHEMBL6937163 0.79 MMP1 (0.33) MMP1MMP9MMP12CES2CES1
SCHEMBL10992653 0.78 MMP1 (0.39) MMP1MMP9MMP12CES2CES1
SCHEMBL6935699 0.78 CA12 (0.37) MMP1MMP9MMP12CES2CES1
Water SCHEMBL19138791 0.77 MMP1 (0.38) MMP1MMP9MMP12CES2CES1
Guanidine SCHEMBL28785879 0.75 MMP1 (0.34) MMP1MMP9MMP12CES2CES1
Water SCHEMBL19138790 0.74 MMP1 (0.36) MMP1MMP9MMP12CES2CES1
Water SCHEMBL19138830 0.74 MMP1 (0.33) MMP1MMP9MMP12ALDH1A1
Water SCHEMBL19138860 0.74 MMP1 (0.33) MMP1MMP9MMP12ALDH1A1
SCHEMBL6940864 0.70 POLB (0.45) ALDH1A1CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402854-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKENE ETHERS NEUROBO PHARMACEUTICALS INC (US) 2022-12-22 US disclosed
EP-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP disclosed
US-11124482-B2 C-met modulators and methods of use EXELIXIS, INC. (US) 2021-09-21 US disclosed
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE EXELIXIS, INC. 2021-08-19 US disclosed
US-20200331860-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2020-10-22 US disclosed
EP-3653598-A1 PROCESSES AND INTERMEDIATES FOR PREPARING , -DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS Gemphire Therapeutics Inc. (US) 2020-05-20 EP disclosed
US-20200048181-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS NEUROBO PHARMACEUTICALS, INC. 2020-02-13 US disclosed
US-10544100-B2 Autophagy inhibitors TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2020-01-28 US disclosed
US-10266518-B2 Solid dosage formulations of substituted quinazoline receptor-type kinase modulators and methods of use thereof SYMPHONY EVOLUTION, INC. (US) 2019-04-23 US disclosed
US-10227285-B2 Processes and intermediates for preparing alpha,omega-dicarboxylic acid-terminated dialkane ethers GEMPHIRE THERAPEUTICS INC. (US) 2019-03-12 US disclosed
WO-2003103575-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-12-18 WO disclosed
WO-2003103599-A2 CASPASE-1 INHIBITORS AND METHODS FOR THEIR USE SUNESIS PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
WO-2003097053-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-11-27 WO disclosed
WO-2003094839-A2 PYRIMIDINONE COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2003-11-20 WO disclosed
WO-2003093297-A2 PROTEIN KINASE MODULATORS AND METHODS OF USE EXELIXIS, INC. (US) 2003-11-13 WO disclosed
WO-2003088903-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-10-30 WO disclosed
US-20030158233-A1 Compositions and methods for treating heart failure CYTOKINETICS, INCORPORATED 2003-08-21 US disclosed
US-20030158186-A1 Compositions and methods for treating heart failure CYTOKINETICS, INCORPORATED 2003-08-21 US disclosed
WO-2003059265-A2 COMPOSITIONS AND METHODS FOR TREATING HEART FAILURE CYTOKINETICS, INC. (US) 2003-07-24 WO disclosed
WO-2003059258-A2 COMPOSITIONS AND METHODS FOR TREATING HEART FAILURE CYTOKINETICS, INC. (US) 2003-07-24 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 (10 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-10544100-B2 Autophagy inhibitors BECN1, ATG7, SQSTM1 MMP1 4599/4885MMP9 4060/4885MMP12 3652/4885
US-20030158233-A1 Compositions and methods for treating heart failure MYH2, TNNI3, MYLK2 MMP1 987/4885MMP9 2380/4885MMP12 2444/4885
US-20200331860-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET MMP1 2656/4885MMP9 681/4885MMP12 1056/4885
US-20220402854-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKENE ETHERS ELOVL3, DGKI, ELOVL5 MMP1 4616/4885MMP9 4649/4885MMP12 4631/4885
US-10266518-B2 Solid dosage formulations of substituted quinazoline receptor-type kinase modulators and methods of use thereof EGFR, ERBB4, ERBB3 MMP1 2705/4885MMP9 1664/4885MMP12 1939/4885
US-10227285-B2 Processes and intermediates for preparing alpha,omega-dicarboxylic acid-terminated dialkane ethers DGKI, DGKA, SQLE MMP1 4228/4885MMP9 4382/4885MMP12 4516/4885
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE FLT4, FLT1, MET MMP1 2656/4885MMP9 681/4885MMP12 1056/4885
US-11124482-B2 C-met modulators and methods of use FLT4, FLT1, MET MMP1 2656/4885MMP9 681/4885MMP12 1056/4885
US-20200048181-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS DGKI, DGKA, SQLE MMP1 4228/4885MMP9 4382/4885MMP12 4516/4885
US-20030158186-A1 Compositions and methods for treating heart failure MYH2, TNNI3, MYLK2 MMP1 987/4885MMP9 2380/4885MMP12 2444/4885

“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.