SCHEMBL14088020

SCHEMBL14088020

CC(C)=CCc1c(C)ccc2oc(=O)cc(C)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 2/20 0.46
▸ HPGD P15428 2/20 0.45
▸ NUDT1 P36639 2/20 0.43
▸ MGAM O43451 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ SI P14410 2/20 0.43
▸ PTPN1 P18031 2/20 0.43
▸ MGAM2 Q2M2H8 2/20 0.43
▸ RELA Q04206 1/20 0.43
▸ PTGS1 P23219 2/20 0.43
▸ VKORC1 Q9BQB6 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ CYP19A1 P11511 2/20 0.42
▸ PGAM1 P18669 2/20 0.42
▸ FASN P49327 2/20 0.42
▸ PTGS2 P35354 2/20 0.42
▸ IDH1 O75874 1/20 0.42
▸ TTR P02766 1/20 0.42
▸ AKR1B1 P15121 1/20 0.42
▸ SIRT2 Q8IXJ6 1/20 0.42

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
SCHEMBL4931168 0.87 PDE4D (0.43) PDE4DHPGDNUDT1MGAMGAA
SCHEMBL14088022 0.83 KDM4E (0.44) HPGDGAAAKR1B1ALDH1A1CYP3A4
SCHEMBL4924821 0.79 VKORC1 (0.39) PDE4DHPGDNUDT1MGAMGAA
SCHEMBL14088024 0.77 ALDH1A1 (0.46) HPGDGAAAKR1B1ALDH1A1CYP3A4
SCHEMBL14088021 0.77 ALDH1A1 (0.39) PDE4DHPGDNUDT1MGAMGAA
SCHEMBL12299958 0.72 PTGS1 (0.74) PDE4DHPGDGAAPTGS1MAOA
SCHEMBL4927312 0.70 PDE4D (0.52) PDE4DHPGDMGAMGAASI
SCHEMBL4925486 0.68 ALDH1A1 (0.43) HPGDGAAAKR1B1ALDH1A1CYP3A4
SCHEMBL24804425 0.67 MAOB (0.46) HPGDPTPN1RELAPTGS1VKORC1
SCHEMBL4922401 0.66 ALDH1A1 (0.46) HPGDGAAAKR1B1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194522-A1 Development of Fluorogenic Substrates For Monoamine Oxidases (Mao-A and Mao-B) TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK, THE 2008-08-14 — — 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-20080194522-A1 Development of Fluorogenic Substrates For Monoamine Oxidases (Mao-A and Mao-B) MAOA, MAOB, COMT PDE4D 430/4885HPGD 296/4885NUDT1 655/4885

“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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