SCHEMBL8370604

SCHEMBL8370604

CNC(=O)/C(=N\OC)c1ccccc1Oc1ccc(Cl)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.40
SLC6A4 P31645 3/20 0.40
KCNH2 Q12809 3/20 0.40
PNLIP P16233 2/20 0.38
MCL1 Q07820 1/20 0.37
GAA P10253 2/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.36
ICAM1 P05362 1/20 0.36
SELE P16581 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 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
SCHEMBL8954931 1.00 HTR2A (0.40) HTR2ASLC6A4KCNH2PNLIPMCL1
SCHEMBL8370606 1.00 HTR2A (0.40) HTR2ASLC6A4KCNH2PNLIPMCL1
SCHEMBL8954668 0.91 HTR2A (0.46) HTR2ASLC6A4KCNH2PNLIP
SCHEMBL8369879 0.91 HTR2A (0.46) HTR2ASLC6A4KCNH2PNLIP
SCHEMBL8369878 0.91 HTR2A (0.46) HTR2ASLC6A4KCNH2PNLIP
SCHEMBL8369610 0.90 HTR2A (0.45) HTR2ASLC6A4KCNH2GAAHTT
SCHEMBL8780068 0.90 HTR2A (0.45) HTR2ASLC6A4KCNH2GAAHTT
SCHEMBL8369608 0.90 HTR2A (0.45) HTR2ASLC6A4KCNH2GAAHTT
SCHEMBL8371659 0.87 CASP1 (0.38) GAAHTTMAPTALDH1A1MEN1
SCHEMBL8371657 0.87 CASP1 (0.38) GAAHTTMAPTALDH1A1MEN1

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-0617011-B1 Process for producing alkoxyiminoacetamide compounds SHIONOGI & CO (JP) 1999-01-20 EP disclosed
US-5506358-A USEFUL AS AGRICULTURAL FUNGICIDES SHIONOGI & CO., LTD. (JP) 1996-04-09 US disclosed
EP-0617011-A2 Process for producing alkoxyiminoacetamide compounds SHIONOGI & CO., LTD. (JP) 1994-09-28 EP disclosed