SCHEMBL1360976

SCHEMBL1360976

CCOC(=S)C(C)Oc1cc(Cl)nc(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 2/20 0.33
MAPT P10636 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 2/20 0.32
LMNA P02545 1/20 0.31
EPHX2 P34913 2/20 0.31
S1PR2 O95136 1/20 0.31
DGAT1 O75907 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
SCHEMBL1360586 0.78 MAPT (0.33) L3MBTL1TDP1KMT2AMAPTPOLB
SCHEMBL10671950 0.78 EPHX2 (0.48) L3MBTL1KMT2AMAPTSMN1; SMN2POLB
SCHEMBL1359268 0.74 KMT2A (0.59) GAATDP1KMT2AMAPTSMN1; SMN2
SCHEMBL1360975 0.71 OGG1 (0.35) L3MBTL1GAATDP1KMT2AMAPT
SCHEMBL2931018 0.70 MAPT (0.38) L3MBTL1GAATDP1KMT2AMAPT
SCHEMBL1360622 0.69 CA2 (0.43) GAATDP1KMT2AMAPTSMN1; SMN2
SCHEMBL5692765 0.67 TTK (0.40) MAPTSMN1; SMN2POLB
SCHEMBL9649784 0.67 CA2 (0.43) L3MBTL1KMT2AMAPTSMN1; SMN2POLB
SCHEMBL1360405 0.67 SMN1; SMN2 (0.36) L3MBTL1MAPTSMN1; SMN2
SCHEMBL26666776 0.66 NQO1 (0.46) TDP1KMT2AMAPTSMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067592-B2 N-alkyny-2-(substituted aryloxy) alkylthioamine derivatives as fungicides SYNGENTA LIMITED (GB) 2011-11-29 US disclosed
EP-1638928-B1 N-ALKYNYL-2-(SUBSTITUTED ARYLOXY)ALKYLTHIOAMIDE DERIVATIVES AS FUNGICIDES SYNGENTA LTD (GB) 2010-09-29 EP disclosed
US-20070042996-A1 N-alkynyl-2-(substituted aryloxy) alkylthioamine derivatives as fungicides SYNGENTA LIMITED (GB) 2007-02-22 US disclosed
EP-1638928-A1 N-ALKYNYL-2-(SUBSTITUTED ARYLOXY)ALKYLTHIOAMIDE DERIVATIVES AS FUNGICIDES Syngenta Limited (GB) 2006-03-29 EP disclosed
WO-2004108663-A1 N-ALKYNYL-2- (SUBSTITUTED ARYLOXY) ALKYLTHIOAMIDE DERIVATIVES AS FUNGICIDES SYNGENTA LIMITED (GB) 2004-12-16 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 (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-20070042996-A1 N-alkynyl-2-(substituted aryloxy) alkylthioamine derivatives as fungicides NAT1, AKR7A2, KCNA2 L3MBTL1 142/4885GAA 1688/4885TDP1 1651/4885

“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.