SCHEMBL11115508

SCHEMBL11115508

CCOP(=O)(SCC)SCCSCC

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
CYP3A4 P08684 1/20 0.55
HSD17B10 Q99714 1/20 0.55
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ACHE P22303 1/20 0.37
TSHR P16473 2/20 0.36
KCNH2 Q12809 1/20 0.35
TP53 P04637 1/20 0.33

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
SCHEMBL11583774 0.90 ALDH1A1 (0.53) ALDH1A1CYP3A4HSD17B10TDP1MEN1
SCHEMBL3817924 0.85 TSHR (0.48) ALDH1A1CYP3A4HSD17B10TDP1ACHE
SCHEMBL11439117 0.82 ALDH1A1 (0.49) ALDH1A1CYP3A4HSD17B10TDP1MEN1
SCHEMBL11439122 0.82 ALDH1A1 (0.49) ALDH1A1CYP3A4HSD17B10TDP1MEN1
SCHEMBL1202631 0.82 ALDH1A1 (0.47) ALDH1A1CYP3A4HSD17B10TDP1MEN1
SCHEMBL8200128 0.82 ALDH1A1 (0.38) ALDH1A1CYP3A4HSD17B10TDP1MEN1
Demeton S SCHEMBL117918 0.79 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10TDP1MEN1
Demeton S SCHEMBL6732303 0.79 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10TDP1MEN1
Ethion SCHEMBL6047155 0.79 ALDH1A1 (0.68) ALDH1A1CYP3A4HSD17B10TDP1MEN1
SCHEMBL29389496 0.78 ALDH1A1 (0.57) ALDH1A1CYP3A4HSD17B10TDP1MEN1

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
EP-0017738-B1 AN INSECTICIDAL AND MITICIDAL COMPOSITION WHICH CONTAINS A CARBAMATE AND AN ORGANIC PHOSPHORUS COMPOUND, AND A METHOD OF CONTROLLING INSECTS AND MITES THEREWITH IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-08-08 EP claimed
EP-0017738-A1 An insecticidal and miticidal composition which contains a carbamate and an organic phosphorus compound, and a method of controlling insects and mites therewith IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-10-29 EP claimed
EP-0017738-A1 An insecticidal and miticidal composition which contains a carbamate and an organic phosphorus compound, and a method of controlling insects and mites therewith IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-10-29 EP disclosed