SCHEMBL77608

SCHEMBL77608

ClC#CCOCc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.50
IDO1 P14902 3/20 0.47
AGXT P21549 2/20 0.47
EGLN1 Q9GZT9 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAOB P27338 4/20 0.39
APP P05067 1/20 0.39
KMT2A Q03164 3/20 0.36
ALOX5 P09917 1/20 0.36
NR4A2 P43354 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL4995796 0.78 IDO1 (0.64) IDO1AGXTSMN1; SMN2USP2GAA
SCHEMBL7213624 0.78 IDO1 (0.48) KCNH2IDO1AGXTEGLN1SMN1; SMN2
SCHEMBL11861626 0.78 IDO1 (0.48) KCNH2IDO1AGXTSMN1; SMN2USP2
SCHEMBL8995755 0.75 IDO1 (0.61) IDO1AGXTSMN1; SMN2USP2GAA
SCHEMBL10372924 0.72 IDO1 (0.52) IDO1AGXTRAB9AMAOBAPP
SCHEMBL28452337 0.72 IDO1 (0.56) IDO1AGXTSMN1; SMN2USP2GAA
SCHEMBL7219594 0.72 IDO1 (0.56) IDO1AGXTSMN1; SMN2USP2GAA
SCHEMBL29588673 0.72 IDO1 (0.56) IDO1AGXTSMN1; SMN2USP2GAA
SCHEMBL17758013 0.71 MAOB (0.42) KCNH2IDO1AGXTMAOBAPP
SCHEMBL14520434 0.70 IDO1 (0.54) IDO1AGXTSMN1; SMN2USP2GAA

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 KCNH2 1184/4885IDO1 541/4885AGXT 2596/4885

“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.