Sugi Predict

Sugi Predict / Compounds / SCHEMBL6790276

SCHEMBL6790276

SCHEMBL6790276

O=C(Cl)SCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ IDO1 P14902 8/20 0.54
▸ NOS3 P29474 1/20 0.54
▸ NOS1 P29475 1/20 0.54
▸ NOS2 P35228 1/20 0.54
▸ CA12 O43570 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ CYP2C19 P33261 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ CES2 O00748 1/20 0.44
▸ CES1 P23141 1/20 0.44
▸ AKR1B1 P15121 1/20 0.44
▸ PAM P19021 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42

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
SCHEMBL79058 0.81 IDO1 (0.58) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL3070200 0.81 IDO1 (0.71) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL11686207 0.80 NOS1 (0.53) TDP1IDO1NOS1ALDH1A1CES1
Hydrochloric Acid SCHEMBL11629727 0.79 IDO1 (0.59) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL2499860 0.79 IDO1 (0.56) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL2364065 0.79 IDO1 (0.69) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL45253 0.78 TDP1 (0.61) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL10927680 0.78 IDO1 (0.57) L3MBTL1IDO1ALDH1A1HDAC3HDAC4
SCHEMBL28184258 0.78 TDP1 (0.61) TDP1L3MBTL1IDO1NOS3NOS1
SCHEMBL42484 0.77 IDO1 (0.54) TDP1L3MBTL1IDO1NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59122459-A — — None — — JP disclosed
JP-8127507-A — — None — — JP disclosed
JP-6239709-A — — None — — JP disclosed
CN-114685334-B Preparation method of prosulfocarb 南通泰禾化工股份有限公司 2024-05-14 — — CN disclosed
CN-117430562-A 4-methyl-2-oxo-3, 6-dihydropyrimidine compound and preparation method and application thereof 中山大学 2024-01-23 — — CN disclosed
US-20220324800-A1 SARS-3CL PROTEASE INHIBITORS Primmune Therapeutics, Inc. 2022-10-13 — — US disclosed
WO-2022212707-A1 SARS-3CL PROTEASE INHIBITORS Primmune Therapeutics, Inc. (US) 2022-10-06 — — WO disclosed
CN-114685334-A Preparation method of prosulfocarb 南通泰禾化工股份有限公司 2022-07-01 — — CN disclosed
US-20210214368-A1 COMPOUNDS FOR THIOL-TRIGGERED COS AND/OR H2S RELEASE AND METHODS OF MAKING AND USING THE SAME UNIVERSITY OF OREGON (US) 2021-07-15 — — US disclosed
US-20040072907-A1 Antipicornaviral compounds, compositions containing them, and methods for their use PETER DRAGOVICH S (US) 2004-04-15 — — US disclosed
US-4740623-A BENZYL CHLORIDE REACTED WITH SODIUM HYDROSULFIDE STAUFFER CHEMICAL COMPANY (US) 1988-04-26 — — US disclosed
US-4695314-A S-benzyl thiolcarbamates and their use in controlling weeds in rice fields STAUFFER CHEMICAL COMPANY (US) 1987-09-22 — — US disclosed
EP-0083648-B1 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS STAUFFER CHEMICAL COMPANY (US) 1986-06-04 — — EP disclosed
JP-S59122459-A BENZAMIDINE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE UBE IND LTD 1984-07-14 — — JP disclosed
EP-0083648-A4 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS. STAUFFER CHEMICAL CO (US) 1984-01-10 — — EP disclosed
EP-0083648-A1 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS. STAUFFER CHEMICAL CO (US) 1983-07-20 — — EP disclosed
WO-1983000329-A1 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS STAUFFER CHEMICAL CO (US) 1983-02-03 — — WO disclosed
US-4097457-A Process for preparing high molecular weight polycarbonates MITSUBISHI GAS CHEMICAL COMPANY, INC. (JA) 1978-06-27 — — US disclosed
US-4040812-A Herbicidal carbonates and thiocarbonates of thiadiazolyl-2(1H)-pyrimidinones VELSICOL CHEMICAL CORPORATION (US) 1977-08-09 — — US disclosed
US-3978107-A NOVEL CYCLOHEXYL CARBAMATES AND HERBICIDAL AND ACARICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DT) 1976-08-31 — — 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 (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-20220324800-A1 SARS-3CL PROTEASE INHIBITORS ACE, ACE2, SARS1 TDP1 1795/4885L3MBTL1 1145/4885IDO1 1482/4885
US-20040072907-A1 Antipicornaviral compounds, compositions containing them, and methods for their use PCNA, ZC3HAV1, POLR1C TDP1 514/4885L3MBTL1 510/4885IDO1 3868/4885
US-20210214368-A1 COMPOUNDS FOR THIOL-TRIGGERED COS AND/OR H2S RELEASE AND METHODS OF MAKING AND USING THE SAME CBS, TST, SQOR TDP1 1987/4885L3MBTL1 1631/4885IDO1 246/4885

“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.