Sugi Predict

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SCHEMBL2780339

SCHEMBL2780339

O=C(O)c1ccc(C2=NOC(c3cc(Cl)cc(C(F)(F)F)c3)(C(F)(F)F)C2)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 8/20 0.38
▸ PDK2 Q15119 1/20 0.33
▸ MPO P05164 1/20 0.32
▸ LTB4R Q15722 3/20 0.32
▸ LTB4R2 Q9NPC1 3/20 0.32
▸ RAPGEF3 O95398 2/20 0.31
▸ RAPGEF4 Q8WZA2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ORAI1 Q96D31 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GRIK1 P39086 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ DHODH Q02127 1/20 0.31

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
SCHEMBL30313890 1.00 ACLY (0.38) ACLYPDK2MPOLTB4RLTB4R2
SCHEMBL31366930 0.93 ACLY (0.33) ACLYRAPGEF3RAPGEF4LMNAPOLB
SCHEMBL871382 0.93 PDK2 (0.36) ACLYPDK2ORAI1MEN1GRIK1
SCHEMBL21863425 0.93 PDK2 (0.36) ACLYPDK2ORAI1MEN1GRIK1
SCHEMBL872236 0.93 RXRA (0.34) ACLYPDK2LTB4RLTB4R2
SCHEMBL20017082 0.93 PDK2 (0.36) ACLYPDK2RAPGEF3RAPGEF4LMNA
SCHEMBL980171 0.90 PDK2 (0.39) ACLYPDK2RAPGEF3LMNAGAA
SCHEMBL870558 0.89 LTB4R (0.32) PDK2LTB4RLTB4R2GRIK1
SCHEMBL870417 0.89 PDK2 (0.34) ACLYPDK2ORAI1DHODH
SCHEMBL13458407 0.89 PDK2 (0.33) PDK2ORAI1DHODH

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 162 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160219872-A1 Foamable Pesticide Compositions And Methods Of Application BASF CORPORATION 2016-08-04 — — US claimed
US-9339030-B2 Foamable pesticide compositions and methods of application BASF CORPORATION (US) 2016-05-17 — — US claimed
US-20150105258-A1 Methods For Controlling Pests BASF CORPORATION (US) 2015-04-16 — — US claimed
US-8980294-B2 Methods for controlling pests BASF CORPORATION (US) 2015-03-17 — — US claimed
US-8940662-B2 Methods for controlling pests BASF CORPORATION (US) 2015-01-27 — — US claimed
US-20140013654-A1 Foamable Pesticide Compositions BASF CORPORATION 2014-01-16 — — US claimed
EP-2654424-A1 PESTICIDAL ACTIVE MIXTURES COMPRISING PYRAZOLE COMPOUNDS BASF SE (DE) 2013-10-30 — — EP claimed
US-20130125267-A1 Pesticidal Mixtures BASF SE (DE) 2013-05-16 — — US claimed
EP-2575471-A1 PESTICIDAL MIXTURES BASF SE (DE) 2013-04-10 — — EP claimed
US-20130012386-A1 Methods For Controlling Pests BASF CORPORATION (US) 2013-01-10 — — US claimed
EP-2470007-A2 FOAMABLE PESTICIDE COMPOSITIONS AND METHODS OF APPLICATION BASF Corporation (US) 2012-07-04 — — EP claimed
WO-2012084670-A1 PESTICIDAL ACTIVE MIXTURES COMPRISING PYRAZOLE COMPOUNDS BASF SE (DE) 2012-06-28 — — WO claimed
US-20120149570-A1 Foamable Pesticide Compositions And Methods Of Application BASF CORPORATION (US) 2012-06-14 — — US claimed
US-20100322892-A1 PESTICIDE COMPOSITIONS AND APPLICATORS BASF CORPORATION (US) 2010-12-23 — — US claimed
US-20100323897-A1 FOAMABLE PESTICIDE COMPOSITIONS BASF CORPORATION (US) 2010-12-23 — — US claimed
US-20100322990-A1 METHODS FOR CONTROLLING PESTS BASF CORPORATION (US) 2010-12-23 — — US claimed
WO-2010129345-A2 FOAMABLE PESTICIDE COMPOSITIONS BASF CORPORATION (US) 2010-11-11 — — WO claimed
WO-2010127019-A1 PESTICIDE COMPOSITIONS AND APPLICATORS BASF CORPORATION (US) 2010-11-04 — — WO claimed
EP-2699563-B3 NOVEL PESTICIDAL PYRAZOLE COMPOUNDS BASF SE (DE) 2024-06-12 — — EP disclosed
WO-2010072602-A1 SUBSTITUTED AMIDINE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2010-07-01 — — 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 (9 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-20120149570-A1 Foamable Pesticide Compositions And Methods Of Application DDT, PLD1, ACHE ACLY 1743/4885PDK2 1599/4885MPO 1451/4885
US-20100323897-A1 FOAMABLE PESTICIDE COMPOSITIONS DDT, PON1, ACHE ACLY 2456/4885PDK2 1918/4885MPO 1112/4885
US-20130012386-A1 Methods For Controlling Pests DDT, ACHE, PON1 ACLY 2143/4885PDK2 3253/4885MPO 1382/4885
US-20130125267-A1 Pesticidal Mixtures DDT, CYP4B1, CYP4X1 ACLY 3792/4885PDK2 3482/4885MPO 1330/4885
US-20100322990-A1 METHODS FOR CONTROLLING PESTS DDT, ACHE, PON1 ACLY 2143/4885PDK2 3253/4885MPO 1382/4885
US-20100322892-A1 PESTICIDE COMPOSITIONS AND APPLICATORS DDT, ACHE, CHRM2 ACLY 2232/4885PDK2 3749/4885MPO 3508/4885
US-20140013654-A1 Foamable Pesticide Compositions DDT, PON1, ACHE ACLY 2456/4885PDK2 1918/4885MPO 1112/4885
US-20150105258-A1 Methods For Controlling Pests DDT, ACHE, PON1 ACLY 2143/4885PDK2 3253/4885MPO 1382/4885
US-20160219872-A1 Foamable Pesticide Compositions And Methods Of Application DDT, PLD1, ACHE ACLY 1743/4885PDK2 1599/4885MPO 1451/4885

“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.