SCHEMBL75802

SCHEMBL75802

CC(=O)OCC#Cc1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
ACACB O00763 1/20 0.43
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
KCNH2 Q12809 1/20 0.39
SLC1A5 Q15758 1/20 0.39
EGLN1 Q9GZT9 3/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
EGLN3 Q9H6Z9 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
SCHEMBL12468934 0.83 CYP1A2 (0.46) CYP2C19ACACBLMNAMEN1KMT2A
SCHEMBL27545848 0.82 ALDH1A1 (0.48) CYP2D6CYP2C19ALDH1A1MAPT
SCHEMBL8950594 0.80 ALDH1A1 (0.39) LMNAKMT2AALDH1A1HPGDMAPT
SCHEMBL18657152 0.78 MAPK1 (0.45) CYP2D6CYP2C19LMNAMEN1KMT2A
SCHEMBL13686083 0.76 HPGD (0.43) ACACBKMT2AALDH1A1RAB9AHPGD
SCHEMBL12016065 0.76 LMNA (0.46) CYP2D6CYP2C19LMNAMEN1KMT2A
SCHEMBL11111466 0.75 ALDH1A1 (0.41) ACACBLMNAMEN1KMT2ACHRM2
SCHEMBL11111469 0.75 ALDH1A1 (0.41) ACACBLMNAMEN1KMT2ACHRM2
SCHEMBL10362542 0.75 LMNA (0.49) LMNAMEN1KMT2ACHRM2CHRM1
SCHEMBL8889185 0.75 ALOX5 (0.40) CYP2D6ACACBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919857-B1 PROCESS FOR THE SYNTHESIS OF MANDIPROPAMID AND DERIVATIVES THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2016-03-09 EP disclosed
US-8129560-B2 Process for the synthesis of mandipropamid and derivatives thereof SYNGENTA CROP PROTECTION, INC. (US) 2012-03-06 US disclosed
US-20090118532-A1 Process for the Synthesis of Mandipropamid and Derivatives Thereof SYNGENTA CROP PROTECTION, INC. (US) 2009-05-07 US disclosed
EP-1919857-A2 PROCESS FOR THE SYNTHESIS OF MANDIPROPAMID AND DERIVATIVES THEREOF Syngeta Participations AG (CH) 2008-05-14 EP disclosed
WO-2007020381-A2 PROCESS FOR THE SYNTHESIS OF MANDIPROPAMID AND DERIVATIVES THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2007-02-22 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-20090118532-A1 Process for the Synthesis of Mandipropamid and Derivatives Thereof OPRM1, OPRD1, ADRA1D CYP2D6 83/4885CYP2C19 101/4885ACACB 2380/4885

“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.