SCHEMBL1016726

SCHEMBL1016726

CC/C(=C/COS(=O)(=O)c1ccc(C)cc1)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.39
ALDH1A1 P00352 5/20 0.36
KMT2A Q03164 5/20 0.36
MEN1 O00255 2/20 0.36
DHODH Q02127 1/20 0.36
GAA P10253 3/20 0.35
CYP2D6 P10635 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TLR9 Q9NR96 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.34
SIRT5 Q9NXA8 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL1016727 1.00 STAT3 (0.39) STAT3ALDH1A1KMT2AMEN1DHODH
SCHEMBL1018380 0.84 DHODH (0.40) STAT3ALDH1A1KMT2AMEN1DHODH
SCHEMBL1018381 0.84 DHODH (0.40) STAT3ALDH1A1KMT2AMEN1DHODH
SCHEMBL8712669 0.79 DHODH (0.50) STAT3ALDH1A1KMT2AMEN1DHODH
SCHEMBL1017020 0.75 TLR9 (0.42) STAT3ALDH1A1KMT2AMEN1GAA
SCHEMBL1017019 0.75 TLR9 (0.42) STAT3ALDH1A1KMT2AMEN1GAA
SCHEMBL7694210 0.74 G6PD (0.47) STAT3ALDH1A1KMT2AGAACYP2D6
SCHEMBL7697212 0.74 G6PD (0.47) STAT3ALDH1A1KMT2AGAACYP2D6
SCHEMBL7694213 0.74 G6PD (0.47) STAT3ALDH1A1KMT2AGAACYP2D6
SCHEMBL7469971 0.73 DHODH (0.38) STAT3ALDH1A1KMT2AMEN1DHODH

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-8247595-B2 Organic sulfur compound and its use for controlling harmful arthropod SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
EP-2152668-B1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPODS SUMITOMO CHEMICAL CO (JP) 2011-01-12 EP disclosed
US-20100160434-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2152668-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed
WO-2008143338-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-11-27 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-20100160434-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD C5, L3MBTL3, C1S STAT3 3575/4885ALDH1A1 363/4885KMT2A 3629/4885

“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.