SCHEMBL2895629

SCHEMBL2895629

Fc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([nH]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[nH]5)C=C4)C=C3)c(F)c1F.[Fe]

nearest known ligand 0.89

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 4/20 0.46
▸ TOP1 P11387 2/20 0.45
▸ CYCS P99999 2/20 0.44
▸ ENPP2 Q13822 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
SCHEMBL174717 0.98 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL1315059 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL30894449 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL31460436 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL1313450 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL4020034 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL3940635 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL1954413 0.96 TERT (0.46) TERTTOP1CYCSENPP2
Hydrochloric Acid SCHEMBL6865971 0.94 TOP1 (0.45) TERTTOP1CYCSENPP2
Hydrochloric Acid SCHEMBL21493256 0.94 TOP1 (0.45) TERTTOP1CYCSENPP2

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
CN-110423185-B Method for selectively oxidizing cumene compound 浙江工业大学 2022-03-18 — — CN claimed
EP-1104427-B1 PROCESS FOR THE PREPARATION OF N-(PHOSPHONOMETHYL)GLYCINE BY OXIDIZING N-SUBSTITUTED N-(PHOSPHONOMETHYL)GLYCINE MONSANTO TECHNOLOGY LLC (US) 2005-03-09 — — EP claimed
US-20040143134-A1 Process for the preparation of N-(phosphonomethyl)glycine by oxidizing N-substituted N-(phosphonomethyl)glycine MONSANTO TECHNOLOGY LLC 2004-07-22 — — US claimed
US-20100167918-A1 ALIGNED CARBON NANOTUBE WITH ELECTRO-CATALYTIC ACTIVITY FOR OXYGEN REDUCTION REACTION THE UNIVERSITY OF CHICAGO (US) 2010-07-01 — — 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-20040143134-A1 Process for the preparation of N-(phosphonomethyl)glycine by oxidizing N-substituted N-(phosphonomethyl)glycine GNMT, GRHPR, GLRA3 TERT 3877/4885TOP1 3845/4885CYCS 858/4885

“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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