SCHEMBL1286192

SCHEMBL1286192

NC(O)=S.OCCN(CCO)C(O)=S

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 1/20 0.39
ALDH2 P05091 1/20 0.39
MAPT P10636 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
SCHEMBL27120166 0.97 CA12 (0.46) CA12CA1CA2CA9ALDH1A1
SCHEMBL27121050 0.97 CA12 (0.46) CA12CA1CA2CA9ALDH1A1
SCHEMBL9437147 0.97 CA12 (0.46) CA12CA1CA2CA9ALDH1A1
SCHEMBL11173025 0.78
SCHEMBL27979265 0.77 CA12 (0.52) CA12CA1CA2CA9ALDH1A1
SCHEMBL442022 0.76 CA12 (0.52) CA12CA1CA2CA9ALDH1A1
SCHEMBL8993636 0.74 CA12 (0.50) CA12CA1CA2CA9ALDH1A1
SCHEMBL16628394 0.74 CA12 (0.50) CA12CA1CA2CA9ALDH1A1
SCHEMBL15157751 0.74 CA12 (0.50) CA12CA1CA2CA9ALDH1A1
Ammonia Solution, Strong SCHEMBL11858080 0.74 CA12 (0.50) CA12CA1CA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2625159-B1 PROCESS FOR INHIBITING UNWANTED FREE-RADICAL POLYMERIZATION OF ACRYLIC ACID PRESENT IN A LIQUID PHASE P BASF SE (DE) 2024-10-02 EP disclosed
US-9212122-B2 Process for inhibiting unwanted free-radical polymerization of acrylic acid present in a liquid phase P BASF SE (DE) 2015-12-15 US disclosed
US-9096513-B2 2015-08-04 US disclosed
WO-2012075259-A1 MOLECULAR PRECURSORS AND PROCESSES FOR PREPARING COPPER INDIUM GALLIUM SULFIDE/SELENIDE COATINGS AND FILMS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-07 WO disclosed
WO-2012071288-A1 SEMICONDUCTOR INKS, FILMS, COATED SUBSTRATES AND METHODS OF PREPARATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-05-31 WO disclosed
US-20120085969-A1 PROCESS FOR INHIBITING UNWANTED FREE-RADICAL POLYMERIZATION OF ACRYLIC ACID PRESENT IN A LIQUID PHASE P BASF SE (DE) 2012-04-12 US disclosed