SCHEMBL692586

SCHEMBL692586

CCOC(=O)c1cc(OC(C)=O)c(OC(C)=O)c(OC(C)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA7 P43166 3/20 0.53
CA9 Q16790 3/20 0.53
CA14 Q9ULX7 3/20 0.53
TOP1 P11387 3/20 0.51
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HSD17B2 P37059 1/20 0.47
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
KDM4E B2RXH2 2/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 2/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAOA P21397 1/20 0.43

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
SCHEMBL6761390 0.87 KDM4E (0.50) CA12CA1CA2CA7CA9
SCHEMBL27790888 0.84 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL6762931 0.84 ESR1 (0.56) ESR1LMNACYP1A2CYP3A4CYP2C9
SCHEMBL6760430 0.83 ESR1 (0.56) ESR1
SCHEMBL12100879 0.82 ESR1 (0.58) ESR1RAB9ANPC1ALDH1A1
SCHEMBL12126419 0.81 CA12 (0.51) CA12CA1CA2CA7CA9
SCHEMBL6759713 0.81 CA12 (0.51) CA12CA1CA2CA7CA9
SCHEMBL9356819 0.81 TOP1 (0.47) TOP1TDP1L3MBTL1HSD17B2KDM4E
SCHEMBL24613975 0.81 POLB (0.55) CA12CA1CA2CA7CA9
SCHEMBL24613989 0.81 POLB (0.55) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334175-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE 1,3 DIONE DERIVATIVES BAYER IP GMBH (DE) 2017-03-01 EP claimed
EP-2635550-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE-1,3-DIONE-DERIVATIVES BAYER IP GMBH (DE) 2016-01-27 EP claimed
US-9204640-B2 2-acyloxy-pyrrolin-4-ones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-08 US claimed
US-9198432-B2 1,2,4-triazolyl-substituted ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US claimed
EP-2681191-B1 2-ACYLOXY-PYRROLIN-4-ONES BAYER IP GMBH (DE) 2015-09-02 EP claimed
EP-2534147-B1 SPIROHETEROCYCLIC-SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-06-17 EP claimed
US-8946124-B2 Substituted 3-(biphenyl-3-yl)-8,8-difluoro-4-hydroxy-1-azaspiro[4.5]dec-3-en-2-ones for therapy and halogen-substituted spirocyclic ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-02-03 US claimed
US-20260144250-A1 SOLVENT-FREE FORMULATIONS OF LOW-MELTING ACTIVE INGREDIENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2026-05-28 US disclosed
US-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2026-05-21 US disclosed
US-12599136-B2 Substituted isophthalic acid diamides and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 2026-04-14 US disclosed
EP-4680598-A1 4-DIFLUOROMETHYL BENZAMIDES WITH HERBICIDAL ACTION Bayer Aktiengesellschaft (DE) 2026-01-21 EP disclosed
US-12509445-B2 Herbicidally active 4-cyclopropyl-6-[4-(trifluormethyl)pyrazol-1-yl)]pyrimidines BAYER AKTIENGESELLSCHAFT (DE) 2025-12-30 US disclosed
EP-4665151-A1 HERBICIDAL MIXTURES Bayer Aktiengesellschaft (DE) 2025-12-24 EP disclosed
US-20100137139-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
US-20100137136-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
US-20100137138-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
EP-2191719-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP disclosed
US-20100062939-A1 Herbicide/Safener Combination Comprising Dimethoxytriazinyl-Substituted Difluoromethanesulfonylanilides BAYER CROPSCIENCE AG (DE) 2010-03-11 US disclosed
US-20040247698-A1 Erectile Dysfunction Treatment VALENZUELA CORTES CARMEN MARIA (CL) 2004-12-09 US disclosed
US-20040224844-A1 Use of hydroxyaromatic compounds as safeners BAYER CROPSCIENCE GMBH (DE) 2004-11-11 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 (10 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-20100137138-A1 HERBICIDE/SAFENER COMBINATION DDT, GSTO1, GAP43 CA12 1137/4885CA1 592/4885CA2 384/4885
US-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES CBR1, CBR3, HDHD5 CA12 2288/4885CA1 983/4885CA2 176/4885
US-20260144250-A1 SOLVENT-FREE FORMULATIONS OF LOW-MELTING ACTIVE INGREDIENTS FOXM1, CSDE1, RCC1 CA12 1607/4885CA1 837/4885CA2 1231/4885
US-20100137136-A1 HERBICIDE/SAFENER COMBINATION DDT, GAP43, CYP2W1 CA12 1112/4885CA1 631/4885CA2 413/4885
US-20100137139-A1 HERBICIDE/SAFENER COMBINATION CYP2W1, DDT, CBR3 CA12 1360/4885CA1 948/4885CA2 502/4885
US-20040224844-A1 Use of hydroxyaromatic compounds as safeners CBR1, CYC1, NR2E1 CA12 3321/4885CA1 1596/4885CA2 1389/4885
US-20040247698-A1 Erectile Dysfunction Treatment PDE3A, PDE3B, PDE12 CA12 4816/4885CA1 4873/4885CA2 4629/4885
US-12509445-B2 Herbicidally active 4-cyclopropyl-6-[4-(trifluormethyl)pyrazol-1-yl)]pyrimidines CBR3, CBR1, HAX1 CA12 2278/4885CA1 328/4885CA2 101/4885
US-12599136-B2 Substituted isophthalic acid diamides and their use as herbicides P4HA1, DDT, CNPY2 CA12 1425/4885CA1 332/4885CA2 49/4885
US-20100062939-A1 Herbicide/Safener Combination Comprising Dimethoxytriazinyl-Substituted Difluoromethanesulfonylanilides DDT, CYP2W1, AS3MT CA12 857/4885CA1 384/4885CA2 198/4885

“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.