Sugi Predict

Sugi Predict / Compounds / SCHEMBL747965

SCHEMBL747965

SCHEMBL747965

C=CCCOc1oc2ccc(I)cc2c(=O)c1CCC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ GAA P10253 1/20 0.33
▸ LTB4R Q15722 2/20 0.32
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA9 Q16790 1/20 0.30
▸ CYP2C9 P11712 2/20 0.30
▸ KDM4E B2RXH2 2/20 0.30
▸ NPC1 O15118 2/20 0.30
▸ RAB9A P51151 2/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CASP3 P42574 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ SENP8 Q96LD8 1/20 0.30
▸ SENP7 Q9BQF6 1/20 0.30
▸ SENP6 Q9GZR1 1/20 0.30
▸ HSD17B3 P37058 1/20 0.30

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
SCHEMBL344030 0.88 CYP2A6 (0.37) APPALDH1A1HPGDLTB4RCA12
SCHEMBL19908366 0.87 MAPT (0.40) ALDH1A1HPGDGAAKDM4ENPC1
SCHEMBL69420 0.87 APP (0.39) APPALDH1A1HPGDLTB4RCA12
SCHEMBL29451185 0.87 APP (0.39) APPALDH1A1HPGDLTB4RCA12
SCHEMBL483576 0.86 LTB4R (0.41) APPALDH1A1HPGDLTB4RCA12
SCHEMBL343039 0.86 KDM4E (0.37) APPALDH1A1HPGDGAALTB4R
SCHEMBL3668856 0.82 APP (0.33) APPALDH1A1HPGDLTB4RCYP2C9
SCHEMBL3668855 0.82 APP (0.33) APPALDH1A1HPGDLTB4RCYP2C9
SCHEMBL6029914 0.82 APP (0.43) APPALDH1A1HPGDCYP2C9KDM4E
SCHEMBL3657351 0.81 LTB4R (0.37) APPALDH1A1HPGDLTB4RCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105670-A1 FUNGICIDAL MIXTURES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-04-29 — — US claimed
EP-2086319-A1 FUNGICIDAL MIXTURES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-08-12 — — EP claimed
WO-2008060611-A1 FUNGICIDAL MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-05-22 — — WO claimed
WO-2005058036-A1 FUNGICIDE COMPOSITION COMPRISING AT LEAST ONE FUNGICIDAL IODOCHROMONE DERIVATIVE AND AT LEAST ONE FUNGICIDAL PYRIMIDINE DERIVATIVE BAYER CROPSCIENCE SA (FR) 2005-06-30 — — WO claimed
EP-1543723-A1 Fungicide composition comprising at least one fungicidal iodochromone derivative and at least one fungicidal pyrimidine derivative Bayer CropScience S.A. (FR) 2005-06-22 — — EP claimed
US-20190174759-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2019-06-13 — — US disclosed
US-10244755-B2 Fungicidal active compound combinations BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-04-02 — — US disclosed
EP-1802197-B1 FUNGICIDAL COMBINATIONS OF ACTIVE INGREDIENTS BAYER IP GMBH (DE) 2018-02-28 — — EP disclosed
US-9844220-B2 Synergistic fungicidal active substance combinations FMC CORPORATION (US) 2017-12-19 — — US disclosed
US-9844220-B2 Synergistic fungicidal active substance combinations FMC CORPORATION (US) 2017-12-19 — — US disclosed
US-9743667-B2 Substituted benzene fungicides E I DU PONT DE NEMOURS AND COMPANY (US) 2017-08-29 — — US disclosed
US-9717247-B2 Synergistic fungicidal active combinations BAYER CROPSCIENCE AG (DE) 2017-08-01 — — US disclosed
EP-1592681-A1 METHOD FOR PREPARING DERIVATIVES OF FUNGICIDAL IODOCHROMONES Bayer CropScience S.A. (FR) 2005-11-09 — — EP disclosed
WO-2005058036-A1 FUNGICIDE COMPOSITION COMPRISING AT LEAST ONE FUNGICIDAL IODOCHROMONE DERIVATIVE AND AT LEAST ONE FUNGICIDAL PYRIMIDINE DERIVATIVE BAYER CROPSCIENCE SA (FR) 2005-06-30 — — WO disclosed
EP-1543723-A1 Fungicide composition comprising at least one fungicidal iodochromone derivative and at least one fungicidal pyrimidine derivative Bayer CropScience S.A. (FR) 2005-06-22 — — EP disclosed
US-20040192672-A1 Iodobenzopyran-4-one derivatives having fungicidal activity BAYER CROPSCIENCE S.A. (FR) 2004-09-30 — — US disclosed
WO-2004069821-A1 METHOD FOR PREPARING DERIVATIVES OF FUNGICIDAL IODOCHROMONES BAYER CROPSCIENCE S.A. (FR) 2004-08-19 — — WO disclosed
EP-1443044-A1 Process for the preparation of fungicide iodo-chromone derivatives Bayer CropScience SA (FR) 2004-08-04 — — EP disclosed
EP-1412344-A1 IODOBENZOPYRAN-4-ONE DERIVATIVES HAVING FUNGICIDAL ACTIVITY Bayer CropScience S.A. (FR) 2004-04-28 — — EP disclosed
WO-2003014103-A1 IODOBENZOPYRAN-4-ONE DERIVATIVES HAVING FUNGICIDAL ACTIVITY BAYER CROPSCIENCE S.A. (FR) 2003-02-20 — — 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 (4 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-20190174759-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATIONS DDT, CYP4X1, CYP51A1 APP 4743/4885ALDH1A1 516/4885HPGD 2294/4885
US-20100105670-A1 FUNGICIDAL MIXTURES DEGS1, GMDS, Q6ZSR9 APP 4627/4885ALDH1A1 988/4885HPGD 2404/4885
US-10244755-B2 Fungicidal active compound combinations DDT, CYP4X1, CYP51A1 APP 4743/4885ALDH1A1 516/4885HPGD 2294/4885
US-20040192672-A1 Iodobenzopyran-4-one derivatives having fungicidal activity GMDS, AKR7A2, DDT APP 4721/4885ALDH1A1 411/4885HPGD 1894/4885

“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.