SCHEMBL77404

SCHEMBL77404

C#CCOC(=O)C(OCC#C)c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
GPX4 P36969 1/20 0.35
ATM Q13315 1/20 0.35
GABBR2 O75899 3/20 0.34
GABBR1 Q9UBS5 3/20 0.34
LMNA P02545 2/20 0.34
CYP2C9 P11712 2/20 0.34
TSHR P16473 2/20 0.34
BRD4 O60885 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
CYP3A4 P08684 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
NFKB1 P19838 1/20 0.34
DRD3 P35462 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
SCHEMBL76511 0.92 PPARG (0.37) NPC1PPARGPPARAFNTAFNTB
SCHEMBL85757 0.88 PPARG (0.35) NPC1PPARGPPARAFNTAFNTB
SCHEMBL76267 0.88 L3MBTL1 (0.44) BRD4HDAC4HDAC7HDAC5MEN1
SCHEMBL75610 0.86 PPARG (0.46) PPARGPPARAGPX4GABBR2GABBR1
SCHEMBL5917972 0.86 PPARG (0.36) NPC1PPARGPPARAGPX4GABBR2
Hydrochloric Acid SCHEMBL5918049 0.84 PPARG (0.44) PPARGPPARAGPX4GABBR2GABBR1
SCHEMBL9855897 0.76 FFAR2 (0.41) NPC1PPARAFNTAFNTBATM
SCHEMBL76084 0.74 LMNA (0.38) GPX4ATMLMNACYP2C9TSHR
SCHEMBL13374095 0.74 PPARG (0.67) PPARGPPARALMNACNR2
SCHEMBL17555049 0.74 NPC1 (0.36) NPC1PPARGPPARAFNTAFNTB

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 9 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
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-8129560-B2 Process for the synthesis of mandipropamid and derivatives thereof SYNGENTA CROP PROTECTION, INC. (US) 2012-03-06 US 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
US-20090118532-A1 Process for the Synthesis of Mandipropamid and Derivatives Thereof SYNGENTA CROP PROTECTION, INC. (US) 2009-05-07 US disclosed
US-20090118532-A1 Process for the Synthesis of Mandipropamid and Derivatives Thereof SYNGENTA CROP PROTECTION, INC. (US) 2009-05-07 US 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 NPC1 2693/4885PPARG 4173/4885PPARA 3458/4885

“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.