SCHEMBL21812367

SCHEMBL21812367

FC1(F)CCN(c2cc(Br)ccn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.39
LRRK2 Q5S007 7/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
PDK1 Q15118 1/20 0.37
PDK2 Q15119 1/20 0.37
OPRD1 P41143 2/20 0.36
WNT1 P04628 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
ACACB O00763 1/20 0.36
CNR2 P34972 1/20 0.36
KIF18A Q8NI77 3/20 0.36
FFAR4 Q5NUL3 1/20 0.36
HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL31346241 1.00 ADRB1 (0.39) ADRB1LRRK2SCN10APDK1PDK2
SCHEMBL30476654 0.80 HRH4 (0.51) ADRB1LRRK2ACACBHRH4
SCHEMBL21812444 0.80 HRH4 (0.47) ADRB1LRRK2ACACBHRH4
SCHEMBL30665756 0.80 HRH4 (0.47) ADRB1LRRK2ACACBHRH4
SCHEMBL789776 0.80 HRH4 (0.51) ADRB1LRRK2ACACBHRH4
SCHEMBL22119280 0.80 OPRD1 (0.54) ADRB1OPRD1KIF18A
SCHEMBL30619312 0.80 OPRD1 (0.54) ADRB1OPRD1KIF18A
SCHEMBL29609326 0.80 GRIN2D (0.50) ADRB1LRRK2PDK1PDK2OPRD1
SCHEMBL24405849 0.79 HRH4 (0.54) ADRB1LRRK2CNR2HRH4
SCHEMBL30701056 0.78 LRRK2 (0.44) LRRK2OPRD1KIF18AFFAR4

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856736-B1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2026-05-06 EP disclosed
US-12522593-B2 Azacycloalkyl carbonyl cyclic amine compound ALIVEXIS, INC. (JP) 2026-01-13 US disclosed
US-20250163041-A1 AZACYCLOALKYL CARBONYL CYCLIC AMINE COMPOUND ALIVEXIS, INC. (JP) 2025-05-22 US disclosed
EP-4538264-A1 AZACYCLOALKYL CARBONYL CYCLIC AMINE COMPOUND Alivexis, Inc. (JP) 2025-04-16 EP disclosed
US-12202816-B2 Compounds as NADPH oxidase inhibitors CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2025-01-21 US disclosed
WO-2023243601-A1 AZACYCLOALKYL CARBONYL CYCLIC AMINE COMPOUND モジュラス株式会社 2023-12-21 WO disclosed
US-20220033379-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2022-02-03 US disclosed
US-20220033379-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2022-02-03 US disclosed
EP-3856736-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GenKyoTex Suisse SA (CH) 2021-08-04 EP disclosed
CN-112930346-A Novel compounds as NADPH oxidase inhibitors 金其尤泰克斯瑞士股份有限公司 2021-06-08 CN disclosed
WO-2020065048-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GENKYOTEX SUISSE SA (CH) 2020-04-02 WO disclosed
EP-3628669-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GenKyoTex Suisse SA (CH) 2020-04-01 EP disclosed
EP-3628669-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GenKyoTex Suisse SA (CH) 2020-04-01 EP 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-20250163041-A1 AZACYCLOALKYL CARBONYL CYCLIC AMINE COMPOUND NCF1, ELANE, MPO ADRB1 1622/4885LRRK2 1322/4885SCN10A 155/4885
US-12202816-B2 Compounds as NADPH oxidase inhibitors CYBB, NOX1, NOX4 ADRB1 1736/4885LRRK2 2586/4885SCN10A 1351/4885
US-20220033379-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CYBB, NOX1, NOX4 ADRB1 1712/4885LRRK2 2528/4885SCN10A 1240/4885

“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.