SCHEMBL5155067

SCHEMBL5155067

CCC#CCOc1ccc(CNNC(=O)[C@@H](NS(C)(=O)=O)C(C)C)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 4/20 0.35
KDM4E B2RXH2 1/20 0.35
RAB9A P51151 2/20 0.35
LARS1 Q9P2J5 1/20 0.35
LMNA P02545 2/20 0.35
TSHR P16473 1/20 0.35
MAPK10 P53779 1/20 0.35
NPC1 O15118 1/20 0.35
PKM P14618 1/20 0.35
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
ADAM17 P78536 1/20 0.35
POLB P06746 1/20 0.35
ATM Q13315 1/20 0.34
TP53 P04637 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
SCHEMBL5159068 0.93 MEN1 (0.43) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5157345 0.89 MEN1 (0.44) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5157467 0.87 MEN1 (0.39) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5157478 0.87 MEN1 (0.39) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5157689 0.86 KMT2A (0.39) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5157545 0.82 MEN1 (0.44) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5157879 0.80 KMT2A (0.39) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2
SCHEMBL5155324 0.80 MEN1 (0.39) MEN1KMT2AMAPK1SMN1; SMN2RAB9A
SCHEMBL5155341 0.80 MEN1 (0.39) MEN1KMT2AMAPK1SMN1; SMN2RAB9A
SCHEMBL7101411 0.78 MEN1 (0.51) MEN1KMT2AMAPK1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189873-B2 Propargylether derivatives, a process for their preparation and their use for controlling phytopathogenic microorganisms SYNGENTA CORP PROTECTION, INC. (US) 2007-03-13 US claimed
EP-1549609-B1 PROPARGYLETHER DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC MICROORGANISMS SYNGENTA PARTICIPATIONS AG (CH) 2007-01-24 EP claimed
US-20060167316-A1 Propargylether derivatives, a process for their preparation and their use for controlling phytopathogenic microorganisms SYNGENTA CROP PROTECTION, INC. 2006-07-27 US claimed
EP-1549609-A2 PROPARGYLETHER DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC MICROORGANISMS Syngenta Participations AG (CH) 2005-07-06 EP claimed
WO-2004033413-A2 PROPARGYLETHER DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC MICROORGANISMS SYNGENTA PARTICIPATIONS AG (CH) 2004-04-22 WO claimed
US-7189873-B2 Propargylether derivatives, a process for their preparation and their use for controlling phytopathogenic microorganisms SYNGENTA CORP PROTECTION, INC. (US) 2007-03-13 US disclosed
EP-1549609-B1 PROPARGYLETHER DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC MICROORGANISMS SYNGENTA PARTICIPATIONS AG (CH) 2007-01-24 EP disclosed
US-20060167316-A1 Propargylether derivatives, a process for their preparation and their use for controlling phytopathogenic microorganisms SYNGENTA CROP PROTECTION, INC. 2006-07-27 US disclosed
EP-1549609-A2 PROPARGYLETHER DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC MICROORGANISMS Syngenta Participations AG (CH) 2005-07-06 EP disclosed
WO-2004033413-A2 PROPARGYLETHER DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC MICROORGANISMS SYNGENTA PARTICIPATIONS AG (CH) 2004-04-22 WO 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 (1 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-20060167316-A1 Propargylether derivatives, a process for their preparation and their use for controlling phytopathogenic microorganisms GRHPR, CBR3, CYP8B1 MEN1 2112/4885KMT2A 3559/4885MAPK1 3668/4885

“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.