SCHEMBL11267015

SCHEMBL11267015

C=CCOC(=O)Nc1cccc(OC(=O)N(CCC)c2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
BCHE P06276 2/20 0.45
ACHE P22303 1/20 0.45
MAPK1 P28482 4/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 2/20 0.39
HPGD P15428 2/20 0.39
RAB9A P51151 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2C19 P33261 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
FAAH O00519 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL11433969 0.94 GAA (0.44) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11431875 0.92 GAA (0.47) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11254486 0.91 MAPK1 (0.46) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11493314 0.90 GAA (0.43) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11437201 0.90 GAA (0.43) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11433689 0.89 GAA (0.45) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11252617 0.89 MAPK1 (0.54) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11656349 0.87 USP2 (0.48) GAABCHEACHEHSD17B10LMNA
SCHEMBL11272522 0.87 GAA (0.43) GAABCHEACHEMAPK1HSD17B10
SCHEMBL11265225 0.86 ALDH1A1 (0.44) GAABCHEACHEMAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4317674-A Diurethanes, process for making the same and selective herbicide composition containing same SCHERING AG (DE) 1982-03-02 US disclosed