SCHEMBL3323719

SCHEMBL3323719

C=CCCSc1nccs1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.56
FBP1 P09467 14/20 0.47
PDK1 Q15118 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.38
FDPS P14324 1/20 0.36
HSD17B3 P37058 1/20 0.33
MAPT P10636 1/20 0.32

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
SCHEMBL15331155 0.81 HTR7 (0.56) HTR7FBP1PDK1SMN1; SMN2FDPS
SCHEMBL5957210 0.81
SCHEMBL7805155 0.79
SCHEMBL8412672 0.78 HTR7 (0.56) HTR7FBP1PDK1SMN1; SMN2FDPS
SCHEMBL4815940 0.77 HTR7 (0.51) HTR7FBP1PDK1SMN1; SMN2FDPS
SCHEMBL7812062 0.76 HTR7 (0.58) HTR7FBP1PDK1SMN1; SMN2FDPS
SCHEMBL12199947 0.75
SCHEMBL1540962 0.75
SCHEMBL6604794 0.75
SCHEMBL6605325 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2010132661-A METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLE MAKHTESHIM CHEMICAL WORKS LTD 2010-06-17 JP disclosed
JP-2010111682-A METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1, 3-THIAZOLE MAKHTESHIM CHEMICAL WORKS LTD 2010-05-20 JP disclosed
US-7439408-B2 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles BAYER CROPSCIENCE AG (DE) 2008-10-21 US disclosed
US-7439408-B2 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles BAYER CROPSCIENCE AG (DE) 2008-10-21 US disclosed
US-7385093-B2 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles MAKHTESHIM CHEMICAL WORKS LTD. (IL) 2008-06-10 US disclosed
US-7385093-B2 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles MAKHTESHIM CHEMICAL WORKS LTD. (IL) 2008-06-10 US disclosed
US-20060183914-A1 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles STRAUB ALEXANDER 2006-08-17 US disclosed
US-20060183914-A1 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles STRAUB ALEXANDER 2006-08-17 US disclosed
US-20060183915-A1 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles MAKHTESHIM CHEMICAL WORKS LTD. (IL) 2006-08-17 US disclosed
US-20060183915-A1 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles MAKHTESHIM CHEMICAL WORKS LTD. (IL) 2006-08-17 US disclosed
US-7078527-B2 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles BAYER CROPSCIENCE AG (DE) 2006-07-18 US disclosed
US-7078527-B2 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles BAYER CROPSCIENCE AG (DE) 2006-07-18 US disclosed
EP-1467980-B1 METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLES BAYER CROPSCIENCE AG (DE) 2005-07-27 EP disclosed
EP-1467980-B1 METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLES BAYER CROPSCIENCE AG (DE) 2005-07-27 EP disclosed
US-20050124816-A1 reacting a 1-halo, mesylate, or tosylate-4,4-difluorobutene with a thiocyanate, giving a butenylthiocyanate; converting to a dithiocarbamate by reacting with hydrogen sulfide; condensation and cyclization with (chloro)acetaldehyde; circumvents 2-mercapto-1,3-thiazole intermediate; by-product inhibition MAKHTESHIM CHEMICAL WORKS LTD. (IL) 2005-06-09 US disclosed
US-20050124816-A1 reacting a 1-halo, mesylate, or tosylate-4,4-difluorobutene with a thiocyanate, giving a butenylthiocyanate; converting to a dithiocarbamate by reacting with hydrogen sulfide; condensation and cyclization with (chloro)acetaldehyde; circumvents 2-mercapto-1,3-thiazole intermediate; by-product inhibition MAKHTESHIM CHEMICAL WORKS LTD. (IL) 2005-06-09 US disclosed
EP-1467980-A1 METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLES Bayer CropScience AG (DE) 2004-10-20 EP disclosed
EP-1467980-A1 METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLES Bayer CropScience AG (DE) 2004-10-20 EP disclosed
WO-2003059896-A1 METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-07-24 WO disclosed
WO-2003059896-A1 METHOD FOR PRODUCING HALOGENATED 2-(3-BUTENYLSULFANYL)-1,3-THIAZOLES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-07-24 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 (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-20050124816-A1 reacting a 1-halo, mesylate, or tosylate-4,4-difluorobutene with a thiocyanate, giving a butenylthiocyanate; converting to a dithiocarbamate by reacting with hydrogen sulfide; condensation and cyclization with (chloro)acetaldehyde; circumvents 2-mercapto-1,3-thiazole intermediate; by-product inhibition TST, CBS, CTH HTR7 2501/4885FBP1 153/4885PDK1 2134/4885
US-20060183915-A1 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles TST, SULT1A1, CTH HTR7 1501/4885FBP1 2149/4885PDK1 2831/4885
US-20060183914-A1 Method for producing halogenated 2-(3-butenylsulphanyl)-1,3-thiazoles HCN4, HCN2, KCNH3 HTR7 3034/4885FBP1 4141/4885PDK1 4600/4885

“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.