Benzyl Carbamimidothioate

Benzyl Carbamimidothioate

SCHEMBL974745

N=C(N)SCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 14/20 1.00
NOS1 P29475 4/20 1.00
NOS3 P29474 1/20 1.00
NOS2 P35228 1/20 1.00
SLC11A2 P49281 1/20 0.76
TAAR1 Q96RJ0 1/20 0.63

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
Benzyl Carbamimidothioate SCHEMBL893859 0.98 IDO1 (1.00) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL28084166 0.98 IDO1 (0.95) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL14576763 0.98 IDO1 (1.00) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL4911682 0.98 IDO1 (1.00) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL28084165 0.96 IDO1 (0.91) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL27962431 0.96 IDO1 (0.91) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL9507886 0.94 IDO1 (0.88) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL27476627 0.92 IDO1 (0.84) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL14714919 0.90 IDO1 (0.81) IDO1NOS1NOS3NOS2SLC11A2
Benzyl Carbamimidothioate SCHEMBL11527781 0.90 IDO1 (0.81) IDO1NOS1NOS3NOS2SLC11A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3473710-B1 SACCHARIFICATION REACTION SOLUTION, SACCHARIFYING ENZYME COMPOSITION, SUGAR PRODUCTION METHOD, AND ETHANOL PRODUCTION METHOD NISSAN CHEMICAL CORP (JP) 2023-09-27 EP claimed
CN-109312318-B Saccharification reaction liquid, saccharifying enzyme composition, method for producing sugar, and method for producing ethanol 日产化学株式会社 2022-06-03 CN claimed
US-20190300921-A1 SACCHARIFICATION REACTION MIXTURE, SACCHARIFICATION ENZYME COMPOSITION, SUGAR PRODUCTION METHOD, AND ETHANOL PRODUCTION METHOD NISSAN CHEMICAL CORPORATION (JP) 2019-10-03 US claimed
EP-3473710-A1 SACCHARIFICATION REACTION SOLUTION, SACCHARIFYING ENZYME COMPOSITION, SUGAR PRODUCTION METHOD, AND ETHANOL PRODUCTION METHOD Nissan Chemical Corporation (JP) 2019-04-24 EP claimed
CN-106084714-A A kind of agricultural mulching and preparation method thereof 吉林省农业科学院 2016-11-09 CN claimed
US-20140221658-A1 INHIBITION OF CELL PROLIFERATION UNIVERSITY OF SOUTH FLORIDA (US) 2014-08-07 US claimed
US-8642278-B2 Inhibition of cell proliferation UNIVERSITY OF SOUTH FLORIDA (US) 2014-02-04 US claimed
WO-2012063115-A2 PROCESS FOR THE PREPARATION OF ROSUVASTATIN CALCIUM VIA NOVEL AMINE INTERMEDIATE JUBILANT LIFE SCIENCES LTD. (IN) 2012-05-18 WO claimed
US-20110190125-A1 2-(BENZYLSULFONYL)OXAZOLE DERIVATIVES, CHIRAL 2-(BENZYLSULFINYL)OXAZOLE DERIVATIVES... BAYER CROPSCIENCE AG (DE) 2011-08-04 US claimed
EP-1962892-A2 INHIBITION OF CELL PROLIFERATION University of South Florida (US) 2008-09-03 EP claimed
EP-1280526-A1 COMPOSITION FOR THE PREVENTION AND/OR TREATMENT, IN NEWBORN BABIES, OF THE EFFECTS OF COMPLICATIONS DURING CHILDBIRTH Universitair Medisch Centrum Utrecht (NL) 2003-02-05 EP claimed
US-20030004340-A1 New 4-arylpiperidine derivatives for the treatment of pruritus GIBSON STEPHEN PAUL (GB) 2003-01-02 US claimed
WO-2001074351-A1 COMPOSITION FOR THE PREVENTION AND/OR TREATMENT, IN NEWBORN BABIES, OF THE EFFECTS OF COMPLICATIONS DURING CHILDBIRTH UNIVERSITAIR MEDISCH CENTRUM (NL) 2001-10-11 WO claimed
EP-1072601-A2 4-arylpiperidine derivatives for the treatment of pruritus PFIZER INC. (US) 2001-01-31 EP claimed
EP-0670720-A1 ENZYME INHIBITORS THE WELLCOME FOUNDATION LIMITED (GB) 1995-09-13 EP claimed
CN-1095710-A Enzyme Inhibitors WELLCOME FOUND (GB) 1994-11-30 CN claimed
WO-1994012165-A2 ENZYME INHIBITORS THE WELLCOME FOUNDATION LIMITED (GB) 1994-06-09 WO claimed
US-4587296-A IMPROVED RETENTION OF PHYSICAL PROPERTIES MONSANTO EUROPE, S.A. (BE) 1986-05-06 US claimed
EP-0070143-B1 ORGANIC THIOSULPHATES AND THIOSULPHONATES USEFUL AS STABILISING AGENTS FOR RUBBER VULCANISATES MONSANTO EUROPE S.A./N.V. (BE) 1985-02-20 EP claimed
EP-0070143-A1 Organic thiosulphates and thiosulphonates useful as stabilising agents for rubber vulcanisates MONSANTO EUROPE S.A./N.V. (BE) 1983-01-19 EP claimed

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-20110190125-A1 2-(BENZYLSULFONYL)OXAZOLE DERIVATIVES, CHIRAL 2-(BENZYLSULFINYL)OXAZOLE DERIVATIVES... BBOX1, STS, OXA1L IDO1 395/4885NOS1 931/4885NOS3 763/4885
US-20030004340-A1 New 4-arylpiperidine derivatives for the treatment of pruritus HRH2, HRH4, HRH1 IDO1 230/4885NOS1 1525/4885NOS3 2250/4885
US-20140221658-A1 INHIBITION OF CELL PROLIFERATION RB1, RAF1, NRAS IDO1 4187/4885NOS1 3526/4885NOS3 3705/4885

“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.