SCHEMBL10199684

SCHEMBL10199684

CCOC(=O)OC1=C(c2c(CC)cc(C)cc2CC)C(=O)C2CCCCC12

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ HPGD P15428 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CCR1 P32246 1/20 0.31
▸ PPOX P50336 2/20 0.30
▸ MAPK1 P28482 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
SCHEMBL10199736 0.94 PDE4A (0.32) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL12885610 0.86 KDM4E (0.33) HPGDKMT2AALDH1A1KDM4EMEN1
SCHEMBL1225992 0.84 KDM4E (0.32) HPGDKMT2AALDH1A1KDM4EMEN1
SCHEMBL10199912 0.83 PPOX (0.31) HPGDALDH1A1HSD17B10SMN1; SMN2PPOX
SCHEMBL10127468 0.81 — —
SCHEMBL16994580 0.80 — —
SCHEMBL4768056 0.79 — —
SCHEMBL2122277 0.78 PPM1B (0.35) KMT2AALDH1A1KDM4EMEN1MAPT
SCHEMBL10258021 0.78 PPM1B (0.35) KMT2AALDH1A1KDM4EMEN1MAPT
SCHEMBL12885551 0.77 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168832-B2 2,4,6-trialkylphenyl substituted cyclopentane-1,3-dione BAYER CROPSCIENCE AG (DE) 2012-05-01 — — US disclosed
US-8168832-B2 2,4,6-trialkylphenyl substituted cyclopentane-1,3-dione BAYER CROPSCIENCE AG (DE) 2012-05-01 — — US disclosed
US-20090137393-A1 2,4,6-TRIALKYLPHENYL SUBSTITUTED CYCLOPENTANE-1,3-DIONE BAYER CROPSCIENCE AG (DE) 2009-05-28 — — US disclosed
US-20090137393-A1 2,4,6-TRIALKYLPHENYL SUBSTITUTED CYCLOPENTANE-1,3-DIONE BAYER CROPSCIENCE AG (DE) 2009-05-28 — — 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 (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-20090137393-A1 2,4,6-TRIALKYLPHENYL SUBSTITUTED CYCLOPENTANE-1,3-DIONE DDT, CYP1B1, CNPY2 PDE4A 720/4885PDE4B 585/4885PDE4C 844/4885

“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.

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