SCHEMBL4874522

SCHEMBL4874522

CCCCCCOC(=S)NC(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.53
ACHE P22303 9/20 0.47
NAAA Q02083 1/20 0.47
CA12 O43570 3/20 0.46
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA9 Q16790 3/20 0.46
FAAH O00519 1/20 0.44
TSHR P16473 2/20 0.43

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
SCHEMBL10563682 0.98 EPHX1 (0.50) EPHX1ACHENAAACA12CA1
SCHEMBL10564570 0.93 ALDH1A1 (0.45) EPHX1ACHECA12CA1CA2
SCHEMBL2942928 0.93 EPHX1 (0.61) EPHX1ACHENAAACA12CA1
SCHEMBL4882104 0.93 EPHX1 (0.61) EPHX1ACHENAAACA12CA1
SCHEMBL5162543 0.91 EPHX1 (0.59) EPHX1ACHENAAACA12CA1
SCHEMBL5164102 0.89 EPHX1 (0.56) EPHX1ACHENAAACA12CA1
SCHEMBL5163094 0.86 EPHX1 (0.47) EPHX1ACHETSHR
SCHEMBL10563632 0.85 HPGD (0.41) ACHE
SCHEMBL4430601 0.85 EPHX1 (0.50) EPHX1ACHETSHR
SCHEMBL5161708 0.84 EPHX1 (0.47) EPHX1ACHENAAACA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2117718-B1 NOVEL DITHIOCARBAMATE COLLECTORS AND THEIR USE IN THE BENEFICATION OF MINERAL ORE BODIES CYTEC TECH CORP (US) 2017-05-10 EP disclosed
US-8376142-B2 Dithiocarbamate collectors and their use in the beneficiation of mineral ore bodies CYTEC TECHNOLOGY CORP. (US) 2013-02-19 US disclosed
US-20080185317-A1 NOVEL DITHIOCARBAMATE COLLECTORS AND THEIR USE IN THE BENEFICIATION OF MINERAL ORE BODIES CYTEC TECHNOLOGY CORP. 2008-08-07 US disclosed
US-4659853-A Process for the production of isothiocyanate derivatives AMERICAN CYANAMID COMPANY (US) 1987-04-21 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 (1 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-20080185317-A1 NOVEL DITHIOCARBAMATE COLLECTORS AND THEIR USE IN THE BENEFICIATION OF MINERAL ORE BODIES FTH1, FECH, SLC40A1 EPHX1 4250/4885ACHE 2006/4885NAAA 2707/4885

“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.