SCHEMBL669359

SCHEMBL669359

FC(F)(F)C(F)(F)C(F)(F)c1ccnc2cc(Cl)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.50
SOS2 Q07890 1/20 0.50
CYP1A2 P05177 1/20 0.45
MAPT P10636 3/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
PKM P14618 2/20 0.43
CCR1 P32246 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP1 P29466 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CHKA P35790 2/20 0.42
FERMT2 Q96AC1 2/20 0.41
MEN1 O00255 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT5B Q4FZB7 1/20 0.40
KMT5C Q86Y97 1/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.40
ADRB2 P07550 1/20 0.40

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
SCHEMBL669631 0.83 NR4A2 (0.56) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL2608428 0.77 NR4A2 (0.56) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL18710418 0.73 NR4A2 (0.51) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL9541547 0.72 NR4A2 (0.54) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL4355081 0.71 NR4A2 (0.61) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL28259104 0.70 NR4A2 (0.56) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL29396540 0.70 NR4A2 (0.66) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL317202 0.70 NR4A2 (0.66) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL9541492 0.70 NR4A2 (0.51) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL27484900 0.70 NR4A2 (0.51) NR4A2SOS2CYP1A2MAPTKMT2A

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
US-9758453-B2 One-component reagent for the fluoroalkylation reaction THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-09-12 US disclosed
US-9758453-B2 One-component reagent for the fluoroalkylation reaction THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-09-12 US disclosed
US-20160185691-A1 One-Component Reagent for the Fluoroalkylation Reaction THE BOARD OF TRUSTEES OF THE UNIVERSITY OF LLLINOIS (US) 2016-06-30 US disclosed
US-20160185691-A1 One-Component Reagent for the Fluoroalkylation Reaction THE BOARD OF TRUSTEES OF THE UNIVERSITY OF LLLINOIS (US) 2016-06-30 US disclosed
US-9193648-B2 Fluoroalkylation methods and reagents BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2015-11-24 US disclosed
US-9193648-B2 Fluoroalkylation methods and reagents BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2015-11-24 US disclosed
US-20130225815-A1 Fluoroalkylation Methods And Reagents THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2013-08-29 US disclosed
US-20130225815-A1 Fluoroalkylation Methods And Reagents THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2013-08-29 US disclosed
EP-2606048-A1 FLUOROALKYLATION METHODS AND REAGENTS The Board of Trustees of the University of Illinois (US) 2013-06-26 EP disclosed
WO-2012024564-A1 FLUOROALKYLATION METHODS AND REAGENTS THE BOARD OF TRUSTESS OF THE UNIVERSITY OF ILLINOIS (US) 2012-02-23 WO 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 (2 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-20130225815-A1 Fluoroalkylation Methods And Reagents ALK, AFF4, AFF2 NR4A2 2963/4885SOS2 2860/4885CYP1A2 1285/4885
US-20160185691-A1 One-Component Reagent for the Fluoroalkylation Reaction AOC1, AOC3, AOC2 NR4A2 4275/4885SOS2 2771/4885CYP1A2 1167/4885

“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.