SCHEMBL20424734

SCHEMBL20424734

Cc1ccc(C(N[S+]([O-])C(C)(C)C)c2ccc(C)o2)c(C)c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL20424817 0.88 — —
SCHEMBL20424864 0.87 MAPT (0.32) —
SCHEMBL23612475 0.87 — —
SCHEMBL23612478 0.87 TP53 (0.30) —
SCHEMBL20425108 0.87 — —
SCHEMBL23589319 0.86 — —
SCHEMBL23589317 0.85 — —
SCHEMBL20424606 0.85 — —
SCHEMBL20424487 0.85 MAPT (0.33) —
SCHEMBL20424835 0.85 PKM (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3573972-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2026-01-14 — — EP disclosed
EP-3573974-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2024-09-18 — — EP disclosed
US-11974997-B2 RORgamma modulators and uses thereof GENFIT (FR) 2024-05-07 — — US disclosed
EP-3573961-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2023-10-25 — — EP disclosed
EP-3573961-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2023-10-25 — — EP disclosed
EP-3573960-B1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2023-08-16 — — EP disclosed
EP-3573960-B1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2023-08-16 — — EP disclosed
US-20220133716-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2022-05-05 — — US disclosed
US-20220133716-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2022-05-05 — — US disclosed
US-11160801-B2 RORgamma modulators and uses thereof GENFIT (FR) 2021-11-02 — — US disclosed
US-11160801-B2 RORgamma modulators and uses thereof GENFIT (FR) 2021-11-02 — — US disclosed
US-11077115-B2 Rorgamma modulators and uses thereof GENFIT (FR) 2021-08-03 — — US disclosed
US-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases GENFIT (FR) 2021-07-06 — — US disclosed
US-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases GENFIT (FR) 2021-07-06 — — US disclosed
US-10987351-B2 RORgamma modulators and uses thereof GENFIT (FR) 2021-04-27 — — US disclosed
US-10987351-B2 RORgamma modulators and uses thereof GENFIT (FR) 2021-04-27 — — US disclosed
WO-2018138356-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2018-08-02 — — WO disclosed
WO-2018138362-A1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXA ZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2018-08-02 — — WO disclosed
WO-2018138354-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2018-08-02 — — WO disclosed
WO-2018138359-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2018-08-02 — — WO disclosed
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