SCHEMBL1954413

SCHEMBL1954413

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.[Zn]

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
SCHEMBL30567459 1.00 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL29582816 0.98 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL29353372 0.98 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL174717 0.98 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL29648942 0.98 TERT (0.47) TERTTOP1CYCSENPP2
SCHEMBL1313450 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL3940635 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL2895629 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL31460436 0.96 TERT (0.46) TERTTOP1CYCSENPP2
SCHEMBL30894449 0.96 TERT (0.46) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110483222-B Selective oxidation method of ethylbenzene compound 浙江工业大学 2022-06-21 — — CN disclosed
CN-110563590-B Method for selective oxidation of toluene compounds 浙江工业大学 2022-03-18 — — CN disclosed
US-10890569-B2 Colorimetric sensor arrays based on nanoporous pigments THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-01-12 — — US disclosed
CN-110563590-A Method for selective oxidation of toluene compounds 浙江工业大学 2019-12-13 — — CN disclosed
US-20180180582-A1 COLORIMETRIC SENSOR ARRAYS BASED ON NANOPOROUS PIGMENTS NATIONAL SCIENCE FOUNDATION 2018-06-28 — — US disclosed
US-9880137-B2 Colorimetric sensor arrays based on nanoporous pigments THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-01-30 — — US disclosed
EP-2331952-B1 COLORIMETRIC SENSOR ARRAYS BASED ON NANOPOROUS PIGMENTS UNIV ILLINOIS (US) 2016-06-15 — — EP disclosed
EP-2331952-A1 COLORIMETRIC SENSOR ARRAYS BASED ON NANOPOROUS PIGMENTS The Board Of Trustees Of The University Of Illinois (US) 2011-06-15 — — EP disclosed
US-20100166604-A1 COLORIMETRIC SENSOR ARRAYS BASED ON NANOPOROUS PIGMENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2010-07-01 — — US disclosed
WO-2010028057-A1 COLORIMETRIC SENSOR ARRAYS BASED ON NANOPOROUS PIGMENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2010-03-11 — — WO disclosed
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