SCHEMBL6741040

SCHEMBL6741040

CC(C)OC(=O)CCCC[S]

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.64
▸ ALDH1A1 P00352 3/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 4/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ TSHR P16473 3/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ PRKCA P17252 1/20 0.36
▸ PRKCE Q02156 1/20 0.36
▸ PRKCQ Q04759 1/20 0.36
▸ PRKCD Q05655 1/20 0.36
▸ CYP1A2 P05177 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
SCHEMBL6740249 0.93 LMNA (0.61) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL8104259 0.89 LMNA (0.78) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL15391 0.89 LMNA (0.78) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL12132118 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL494007 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL10788600 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL495551 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL494255 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL495050 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1
SCHEMBL495594 0.86 LMNA (0.83) LMNAALDH1A1GAAMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040043903-A1 Herbicides; applying to plants BASF AKTIENGESELLSCHAFT (DE) 2004-03-04 — — US disclosed
US-20040023807-A1 3-Arylisothiazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2004-02-05 — — US disclosed
US-20030216257-A1 1-aryl-4-alkyl halide-2(1h)-pyridones and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2003-11-20 — — 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 (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-20040023807-A1 3-Arylisothiazoles and their use as herbicides DDT, HAX1, SULT1E1 LMNA 4564/4885ALDH1A1 142/4885GAA 1233/4885
US-20040043903-A1 Herbicides; applying to plants DDT, DRD1, DRD4 LMNA 4573/4885ALDH1A1 171/4885GAA 1144/4885
US-20030216257-A1 1-aryl-4-alkyl halide-2(1h)-pyridones and their use as herbicides CYP1B1, DDT, CYP1A1 LMNA 3218/4885ALDH1A1 15/4885GAA 1778/4885

“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.

Send feedback