SCHEMBL421763

SCHEMBL421763

FC(F)(F)c1cc(Cl)c(Br)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 6/20 0.42
GABRA2 P47869 5/20 0.42
GABRB2 P47870 5/20 0.42
GABRP O00591 2/20 0.42
GABRD O14764 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRB1 P18505 2/20 0.42
GABRG2 P18507 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA4 P48169 2/20 0.42
GABRE P78334 2/20 0.42
GABRA6 Q16445 2/20 0.42
GABRG1 Q8N1C3 2/20 0.42
GABRG3 Q99928 2/20 0.42
GABRQ Q9UN88 2/20 0.42
PDE2A O00408 2/20 0.39
ALDH1A1 P00352 5/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL13550115 0.86 GABRB3 (0.42) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL30849289 0.86 RXRA (0.40) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL31513958 0.86 GABRB3 (0.39) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL5355959 0.80 ALDH1A1 (0.32) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL22366835 0.80 TDP1 (0.38) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL22366922 0.80 GABRB3 (0.48) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL27853403 0.78 CES2 (0.38) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL981089 0.78 ALDH1A1 (0.46) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL29129632 0.77 PDE2A (0.32) PDE2A
SCHEMBL10680627 0.77 GABRB3 (0.36) GABRB3GABRA2GABRB2GABRPGABRD

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114621270-B Condensed ring aromatic compound and application thereof in electroluminescent device 清华大学 2024-04-12 CN disclosed
CN-114621269-B Condensed ring aromatic compound and application thereof in electroluminescent device 清华大学 2024-04-09 CN disclosed
CN-114621270-A Fused aromatic compound and application thereof in electroluminescent device 清华大学 2022-06-14 CN disclosed
CN-114621269-A Fused aromatic compound and application thereof in electroluminescent device 清华大学 2022-06-14 CN disclosed
EP-2310357-B1 POTASSIUM ION CHANNEL MODULATORS & USES THEREOF RAMOT AT TEL AVIV UNIV LIMITED (IL) 2019-09-11 EP disclosed
EP-3412658-A1 PROCESSES FOR THE MANUFACTURE OF SULFUR-SUBSTITUED PYRAZOLE DERIVATIVES SOLVAY SA (BE) 2018-12-12 EP disclosed
US-9675567-B2 Potassium ion channel modulators and uses thereof RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2017-06-13 US disclosed
US-20160374969-A1 POTASSIUM ION CHANNEL MODULATORS & USES THEREOF RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-12-29 US disclosed
US-9464052-B2 Potassium ion channel modulators and uses thereof RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-10-11 US disclosed
EP-2470498-B1 CARBOCYCLIC GLYT1 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2015-02-11 EP disclosed
US-5747424-A HEATING AN AROMATIC DIKETONE WITH A SALT OF HYDROXYLAMINE IN A SOLVENT RHONE-POULENC AGRICULTURE LTD. (GB) 1998-05-05 US disclosed
US-5739083-A LOW IN TOXICITY AND PERSISTENCE OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1998-04-14 US disclosed
EP-0802191-A1 PYRAZOLE DERIVATIVES AND INSECTICIDAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENT OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-10-22 EP disclosed
US-5656573-A Herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-12 US disclosed
US-5650533-A Intermediates to herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-07-22 US disclosed
US-5380865-A Halogen substituents MAY & BAKER LIMITED (GB) 1995-01-10 US disclosed
US-5206257-A Controlling plant nematodes, helminth, protozoa MAY & BAKER LIMITED (GB) 1993-04-27 US disclosed
EP-0283173-A1 Pesticidal method using 2-phenylimidazole derivatives RHONE-POULENC AGRICULTURE LIMITED (GB) 1988-09-21 EP disclosed
US-4584396-A Substituted phenoxypropionates and herbicidal compositions NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-04-22 US disclosed
US-4441913-A PRE- AND POST-EMERGENCE NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1984-04-10 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-20160374969-A1 POTASSIUM ION CHANNEL MODULATORS & USES THEREOF KCNJ11, KCNJ1, KCNJ2 GABRB3 316/4885GABRA2 274/4885GABRB2 318/4885

“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.