SCHEMBL21608777

SCHEMBL21608777

COc1nc(N)c(F)cc1OCC(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 1/20 0.36
▸ P2RX2 Q9UBL9 1/20 0.36
▸ PIK3CA P42336 3/20 0.35
▸ PIK3CG P48736 3/20 0.35
▸ PIK3CD O00329 2/20 0.35
▸ SCN9A Q15858 2/20 0.34
▸ BACE1 P56817 3/20 0.33
▸ BACE2 Q9Y5Z0 3/20 0.33
▸ REN P00797 2/20 0.33
▸ CTSD P07339 2/20 0.33
▸ SCN5A Q14524 1/20 0.33
▸ TLR8 Q9NR97 2/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HTR2A P28223 2/20 0.31
▸ ACACB O00763 3/20 0.31

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
SCHEMBL30723514 1.00 P2RX3 (0.36) P2RX3P2RX2PIK3CAPIK3CGPIK3CD
SCHEMBL34471808 0.82 ACACB (0.31) ACACBEGFRKDR
SCHEMBL29778792 0.81 CYBB (0.35) P2RX3P2RX2PIK3CAPIK3CGPIK3CD
SCHEMBL23641394 0.81 CYBB (0.35) P2RX3P2RX2PIK3CAPIK3CGPIK3CD
SCHEMBL21608759 0.81 BACE1 (0.33) P2RX3P2RX2SCN9ABACE1BACE2
SCHEMBL29778825 0.81 BACE1 (0.33) P2RX3P2RX2SCN9ABACE1BACE2
SCHEMBL30731668 0.80 HTR2A (0.38) P2RX3P2RX2PIK3CAHTR2A
SCHEMBL26977593 0.80 HTR2A (0.38) P2RX3P2RX2PIK3CAHTR2A
SCHEMBL27038877 0.80 P2RX3 (0.35) P2RX3P2RX2PIK3CAPIK3CGPIK3CD
SCHEMBL30559743 0.75 NUDT1 (0.44) P2RX3P2RX2MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260027104-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2026-01-29 — — US disclosed
US-20250296931-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2025-09-25 — — US disclosed
EP-4558483-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-05-28 — — EP disclosed
EP-4558479-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-05-28 — — EP disclosed
WO-2024115733-A1 FUSED PYRROLYL-SULFONAMIDE COMPOUNDS REWIND THERAPEUTICS NV (BE) 2024-06-06 — — WO disclosed
US-11976056-B2 Substituted alkoxypyridinyl indolsulfonamides UCB PHARMA GMBH (DE) 2024-05-07 — — US disclosed
WO-2024017856-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 — — WO disclosed
WO-2024017856-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 — — WO disclosed
WO-2024017858-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 — — WO disclosed
WO-2024017858-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 — — WO disclosed
WO-2024017857-A1 NOVEL IMIDAZOPYRIDINE AND PYRAZOLOPYRIDINE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 — — WO disclosed
EP-4086248-A1 SUBSTITUTED ALKOXYPYRIDINYL INDOLSULFONAMIDES UCB Pharma GmbH (DE) 2022-11-09 — — EP disclosed
EP-3810587-B1 SUBSTITUTED ALKOXYPYRIDINYL INDOLSULFONAMIDES UCB PHARMA GMBH (DE) 2022-08-10 — — EP disclosed
US-20210214337-A1 SUBSTITUTED ALKOXYPYRIDINYL INDOLSULFONAMIDES UCB PHARMA GMBH (DE) 2021-07-15 — — US disclosed
WO-2019243398-A1 SUBSTITUTED ALKOXYPYRIDINYL INDOLSULFONAMIDES UCB PHARMA GMBH (DE) 2019-12-26 — — 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 (4 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-20250296931-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES SULT1E1, XDH, PRXL2A P2RX3 188/4885P2RX2 323/4885PIK3CA 637/4885
US-20260027104-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES CBR3, HAX1, CBR1 P2RX3 671/4885P2RX2 1034/4885PIK3CA 3320/4885
US-20210214337-A1 SUBSTITUTED ALKOXYPYRIDINYL INDOLSULFONAMIDES GPR119, GPR17, GPR27 P2RX3 537/4885P2RX2 560/4885PIK3CA 2521/4885
US-11976056-B2 Substituted alkoxypyridinyl indolsulfonamides GPR119, GPR17, GPR27 P2RX3 537/4885P2RX2 560/4885PIK3CA 2521/4885

“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.

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