SCHEMBL12070755

SCHEMBL12070755

N#Cc1ccc(-c2ccncc2SCC(=O)O)c2ccccc12

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 20/20 0.82
▸ SLC22A6 Q4U2R8 2/20 0.57
▸ SLC22A11 Q9NSA0 1/20 0.57
▸ ABCG2 Q9UNQ0 1/20 0.53

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
SCHEMBL12070811 0.90 SLC22A12 (1.00) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL21727899 0.81 SLC22A12 (0.83) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL9987801 0.81 SLC22A12 (1.00) SLC22A12SLC22A6SLC22A11
SCHEMBL12070757 0.80 SLC22A12 (0.83) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL21350889 0.80 SLC22A12 (0.70) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL28417540 0.80 SLC22A12 (0.70) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL12070740 0.79 SLC22A12 (0.77) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL12069316 0.79 SLC22A12 (0.73) SLC22A12SLC22A6SLC22A11
SCHEMBL17545598 0.79 SLC22A12 (0.74) SLC22A12SLC22A6SLC22A11ABCG2
SCHEMBL17540566 0.79 SLC22A12 (1.00) SLC22A12SLC22A6SLC22A11ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210171466-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE AREDEA BIOSCIENCES, INC. 2021-06-10 — — US disclosed
US-10919858-B2 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES, INC (US) 2021-02-16 — — US disclosed
EP-3611167-A1 THIOACETATE COMPOUND AND METHODS OF USE Ardea Biosciences, Inc. (US) 2020-02-19 — — EP disclosed
US-20190185431-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. 2019-06-20 — — US disclosed
US-10266493-B2 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2019-04-23 — — US disclosed
EP-2975025-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE Ardea Biosciences, Inc. (US) 2016-01-20 — — EP disclosed
EP-2712861-B1 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES INC (US) 2015-07-29 — — EP disclosed
EP-2585437-B1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES INC (US) 2014-02-12 — — EP disclosed
US-8629278-B2 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2014-01-14 — — US disclosed
US-8629278-B2 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2014-01-14 — — US disclosed
US-20130281469-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. 2013-10-24 — — US disclosed
US-20130281469-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. 2013-10-24 — — US disclosed
US-8541589-B2 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2013-09-24 — — US disclosed
US-8541589-B2 Thioacetate compounds, compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2013-09-24 — — US disclosed
US-20130203779-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2013-08-08 — — US disclosed
US-20130203779-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2013-08-08 — — US disclosed
US-20130202573-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2013-08-08 — — US disclosed
US-20130202573-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2013-08-08 — — US disclosed
WO-2011159839-A2 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-12-22 — — 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 (7 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-20130202573-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885
US-10266493-B2 Thioacetate compounds, compositions and methods of use TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885
US-20210171466-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885
US-10919858-B2 Thioacetate compounds, compositions and methods of use TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885
US-20130203779-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885
US-20130281469-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885
US-20190185431-A1 THIOACETATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TXN, TXN2, XDH SLC22A12 757/4885SLC22A6 477/4885SLC22A11 594/4885

“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.

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