SCHEMBL11437201

SCHEMBL11437201

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
KMT2A Q03164 4/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 2/20 0.38
MAPK1 P28482 3/20 0.37
CYP1A2 P05177 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.36
FAAH O00519 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
CASP1 P29466 1/20 0.36
F2R P25116 1/20 0.35

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
SCHEMBL11266315 0.91 MEN1 (0.43) GAAKMT2ANPC1RAB9AMEN1
SCHEMBL11493314 0.90 GAA (0.43) GAABCHEACHEKMT2ANPC1
SCHEMBL11267015 0.90 GAA (0.45) GAABCHEACHEKMT2ANPC1
SCHEMBL11433689 0.89 GAA (0.45) GAABCHEACHEKMT2ANPC1
SCHEMBL11433969 0.88 GAA (0.44) GAABCHEACHENPC1RAB9A
SCHEMBL11256425 0.88 GAA (0.39) GAAKMT2ARAB9AMEN1MAPK1
SCHEMBL11431875 0.88 GAA (0.47) GAABCHEACHEKMT2ANPC1
SCHEMBL11656349 0.87 USP2 (0.48) GAABCHEACHEKMT2ANPC1
SCHEMBL11423852 0.87 MAPK1 (0.52) GAABCHEACHEKMT2ANPC1
SCHEMBL11426779 0.85 ALDH1A1 (0.51) BCHEACHEKMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4202684-A Carbanilic acid esters, process for making the same and herbicidal compositions containing same SCHERING AKTIENGESELLSCHAFT (DE) 1980-05-13 US claimed
US-4202684-A Carbanilic acid esters, process for making the same and herbicidal compositions containing same SCHERING AKTIENGESELLSCHAFT (DE) 1980-05-13 US disclosed