Sugi Predict

Sugi Predict / Compounds / SCHEMBL675023

SCHEMBL675023

SCHEMBL675023

CCON=C(C(=O)O)c1ccccc1CON=C(C)c1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 9/20 0.47
▸ PPARA Q07869 8/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HIF1A Q16665 2/20 0.43
▸ DDR1 Q08345 1/20 0.40
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ RXFP1 Q9HBX9 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL6061921 1.00 PPARG (0.47) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL350193 1.00 PPARG (0.47) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL4552051 1.00 PPARG (0.47) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL2792516 0.91 HIF1A (0.52) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL5112727 0.91 HIF1A (0.52) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL28652083 0.91 HIF1A (0.52) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL27039060 0.91 HIF1A (0.52) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL2792522 0.91 HIF1A (0.52) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL26650820 0.91 HIF1A (0.52) PPARGPPARAMEN1KMT2AHIF1A
SCHEMBL30158137 0.90 MEN1 (0.45) PPARGPPARAMEN1KMT2AHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060159772-A1 Fungicidal compositions ISAGRO S.P.A. (IT) 2006-07-20 — — US claimed
US-10759767-B2 Compositions comprising a triazole compound BASF Agro B.V. (NL) 2020-09-01 — — US disclosed
US-10206391-B2 Strobilurin formulations VIVE CROP PROTECTION INC. (CA) 2019-02-19 — — US disclosed
US-20170035050-A1 Pesticidal mixtures comprising a pyrazole compound BASF SE (DE) 2017-02-09 — — US disclosed
WO-2016034706-A1 ANTI-BOTRYTIS COMPOSITIONS LESAFFRE ET COMPAGNIE (FR) 2016-03-10 — — WO disclosed
US-20150344445-A1 COMPOSITIONS COMPRISING A TRIAZOLE COMPOUND BASF Agro B.V. (NL) 2015-12-03 — — US disclosed
US-20140364310-A1 STROBILURIN FORMULATIONS VIVE CROP PROTECTION INC. (CA) 2014-12-11 — — US disclosed
US-8679514-B2 Fungicidal mixtures based on azolopyrimidinylamines BASF SE (DE) 2014-03-25 — — US disclosed
US-8153819-B2 Fungicidal mixtures comprising substituted 1-methylpyrazol-4-ylcarboxanilides BASF SE (DE) 2012-04-10 — — US disclosed
US-20110177944-A1 Synergistic Fungicidal Mixtures BASF SE (DE) 2011-07-21 — — US disclosed
US-20110159107-A1 Pesticidal Mixtures Comprising Isoxazoline Compounds II BASF SE (DE) 2011-06-30 — — US disclosed
US-20110136665-A1 Ternary Fungicidal Mixtures BASF AKTIENGESELLSCHAFT (DE) 2011-06-09 — — US disclosed
US-20110105321-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds BASF SE (DE) 2011-05-05 — — US disclosed
EP-2091331-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2009-08-26 — — EP disclosed
US-20080234295-A1 Fungicidal Mixtures Based on Azolopyrimidinylamines BASF AKTIENGELSELLSCHAFT (DE) 2008-09-25 — — US disclosed
WO-2008092818-A2 PESTICIDAL MIXTURES BASF SE (DE) 2008-08-07 — — WO disclosed
WO-2008034787-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2008-03-27 — — WO disclosed
US-20070293395-A1 Use of 2-Substituted Pyrimidines for Combating Nematode Diseases of Plants BASF AKTIENGESELLSCHAFT (DE) 2007-12-20 — — US 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 (11 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-20110136665-A1 Ternary Fungicidal Mixtures AS3MT, TH, DDT PPARG 1800/4885PPARA 1633/4885MEN1 2832/4885
US-20140364310-A1 STROBILURIN FORMULATIONS CD63, SNU13, SNX1 PPARG 4807/4885PPARA 4741/4885MEN1 2027/4885
US-20170035050-A1 Pesticidal mixtures comprising a pyrazole compound API5, ATL3, PFAS PPARG 2039/4885PPARA 1984/4885MEN1 2082/4885
US-20110159107-A1 Pesticidal Mixtures Comprising Isoxazoline Compounds II PRDX1, PRDX2, PRDX5 PPARG 3180/4885PPARA 3248/4885MEN1 1495/4885
US-20150344445-A1 COMPOSITIONS COMPRISING A TRIAZOLE COMPOUND CYP1B1, CYP3A5, CYP4B1 PPARG 584/4885PPARA 1951/4885MEN1 2165/4885
US-20110105321-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds CPN1, SRM, STS PPARG 4209/4885PPARA 4266/4885MEN1 504/4885
US-20110177944-A1 Synergistic Fungicidal Mixtures CYP3A5, CYP51A1, CYP3A7 PPARG 1171/4885PPARA 1570/4885MEN1 3296/4885
US-10206391-B2 Strobilurin formulations CD63, SNU13, SNX1 PPARG 4807/4885PPARA 4741/4885MEN1 2027/4885
US-20080234295-A1 Fungicidal Mixtures Based on Azolopyrimidinylamines DDT, STS, ARSA PPARG 1717/4885PPARA 2519/4885MEN1 105/4885
US-10759767-B2 Compositions comprising a triazole compound CYP1B1, CYP3A5, CYP4B1 PPARG 584/4885PPARA 1951/4885MEN1 2165/4885
US-20070293395-A1 Use of 2-Substituted Pyrimidines for Combating Nematode Diseases of Plants TYMS, UMPS, NUDT1 PPARG 3358/4885PPARA 3632/4885MEN1 4674/4885

“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.