SCHEMBL7713740

SCHEMBL7713740

Nc1c(Cl)cc(C(F)(F)F)cc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
GABRA2 P47869 6/20 0.41
GABRB2 P47870 6/20 0.41
GABRP O00591 5/20 0.41
GABRD O14764 5/20 0.41
GABRA1 P14867 5/20 0.41
GABRB1 P18505 5/20 0.41
GABRG2 P18507 5/20 0.41
GABRB3 P28472 5/20 0.41
GABRA5 P31644 5/20 0.41
GABRA3 P34903 5/20 0.41
GABRA4 P48169 5/20 0.41
GABRE P78334 5/20 0.41
GABRA6 Q16445 5/20 0.41
GABRG1 Q8N1C3 5/20 0.41
GABRG3 Q99928 5/20 0.41
GABRQ Q9UN88 5/20 0.41
ALDH1A1 P00352 6/20 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
SCHEMBL29778899 1.00 CA1 (0.46) CA1CA2CA9GABRA2GABRB2
SCHEMBL30439201 0.84 ALDH1A1 (0.50) CA1CA2CA9GABRA2GABRB2
SCHEMBL964964 0.84 GAA (0.50) CA1CA2CA9GABRB3ALDH1A1
SCHEMBL967220 0.84 ALDH1A1 (0.50) CA1CA2CA9GABRA2GABRB2
SCHEMBL289233 0.84 CA1 (0.43) CA1CA2CA9GABRA2GABRB2
Hydrochloric Acid SCHEMBL29123267 0.82 ALDH1A1 (0.48) CA1CA2CA9GABRA2GABRB2
SCHEMBL17174592 0.81 CA1 (0.41) CA1CA2CA9GABRA2GABRB2
SCHEMBL18355927 0.81 CA1 (0.41) CA1CA2CA9ALDH1A1KDM4E
SCHEMBL3697730 0.81 CA1 (0.41) CA1CA2CA9ALDH1A1KDM4E
Nitrogen SCHEMBL28714282 0.80 ALDH1A1 (0.46) CA1CA2CA9GABRA2GABRB2

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
EP-4650345-A1 HETEROCYCLIC COMPOUND AND USE THEREOF IN MEDICINE Kangbaida (Sichuan) Biotechnology Co., Ltd. (CN) 2025-11-19 EP disclosed
US-20250154107-A1 3,4-Dihydroisoquinolin-1(2H)-Ones Derivatives as STING Antagonists and the Use Thereof BEIGENE SWITZERLAND GMBH (CH) 2025-05-15 US disclosed
EP-4448513-A1 3, 4-DIHYDROISOQUINOLIN-1 (2H) -ONES DERIVATIVES AS STING ANTAGONISTS AND THE USE THEREOF BeiGene Switzerland GmbH (CH) 2024-10-23 EP disclosed
CN-118401514-A 3, 4-Dihydroisoquinolin-1 (2H) -one derivatives as STING antagonists and uses thereof 百济神州有限公司 2024-07-26 CN disclosed
WO-2024149242-A1 HETEROCYCLIC COMPOUND AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2024-07-18 WO disclosed
WO-2023109912-A1 3, 4-DIHYDROISOQUINOLIN-1 (2H) -ONES DERIVATIVES AS STING ANTAGONISTS AND THE USE THEREOF BEIGENE, LTD. (KY) 2023-06-22 WO disclosed
CN-112313231-B OGA inhibitor compounds 詹森药业有限公司 2023-05-09 CN disclosed
EP-3810608-B1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2022-08-10 EP disclosed
US-11401271-B2 Fused heterocyclic compound, pyrazole-ring-containing fused heterocyclic compound, agricultural composition containing thereof, and method of using the composition SOUTH CHINA AGRICULTURAL UNIVERSITY (CN) 2022-08-02 US disclosed
US-20210188853-A1 FUSED HETEROCYCLIC COMPOUND, PYRAZOLE-RING-CONTAINING FUSED HETEROCYCLIC COMPOUND, AGRICULTURAL COMPOSITION CONTAINING THEREOF, AND METHOD OF USING THE COMPOSITION SOUTH CHINA AGRICULTURAL UNIVERSITY (CN) 2021-06-24 US disclosed
US-5916618-A PESTICIDE FOR MEDICATED FEEDSTUFF, DIETARY CONCENTRATE OR SUPPLEMENT RHONE-POULENC AGRICULTURE LTD. (GB) 1999-06-29 US disclosed
US-5714191-A PESTICIDES USED IN MEDICATED FEEDSTUFF, MINERAL SALT LICK OR EDIBLE BAIT RHONE-POULENC AGRICULTURE LTD. (GB) 1998-02-03 US disclosed
US-5608077-A INSECTICIDES, NEMATOCIDES, ANTHELMINTICS, ANTIPROTOZOA AGENTS RHONE-POULENC AGRICULTURE LTD. (GB) 1997-03-04 US disclosed
US-5547974-A INSECTICIDES, NEMATOCIDES, ANTHELMINTICS RHONE-POULENC AGRICULTURE LTD. (GB) 1996-08-20 US disclosed
US-5232940-A Controlling insects, plant nematodes, helminths, protozoa BASF AGRO B.V., ARNHEM (NL), WADENSWIL-BRANCH (CH) 1993-08-03 US disclosed
EP-0295117-A1 Derivatives of N-phenylpyrazoles RHONE-POULENC AGRICULTURE LIMITED (GB) 1988-12-14 EP disclosed
US-4725607-A MITICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-02-16 US disclosed
EP-0216541-A1 Aryl pyridones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-04-01 EP disclosed
US-4237048-A COLORFASTNESS; FOR DYEING NATURAL AND SYNTHETIC FIBERS BAYER AKTIENGESELLSCHAFT (DE) 1980-12-02 US disclosed
US-4105655-A PHENYL-AZO-ANILINO DYESTUFF BAYER AKTIENGESELLSCHAFT (DE) 1978-08-08 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 (3 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-11401271-B2 Fused heterocyclic compound, pyrazole-ring-containing fused heterocyclic compound, agricultural composition containing thereof, and method of using the composition SYMPK, DDT, CYP51A1 CA1 1195/4885CA2 1393/4885CA9 1122/4885
US-20210188853-A1 FUSED HETEROCYCLIC COMPOUND, PYRAZOLE-RING-CONTAINING FUSED HETEROCYCLIC COMPOUND, AGRICULTURAL COMPOSITION CONTAINING THEREOF, AND METHOD OF USING THE COMPOSITION SYMPK, DDT, CYP51A1 CA1 1195/4885CA2 1393/4885CA9 1122/4885
US-20250154107-A1 3,4-Dihydroisoquinolin-1(2H)-Ones Derivatives as STING Antagonists and the Use Thereof STING1, IRF3, MAVS CA1 4877/4885CA2 4350/4885CA9 4830/4885

“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.