SCHEMBL27033314

SCHEMBL27033314

CC(C)c1c(O)cc(-c2ccc3cc(F)ccc3n2)cc1OS(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.34
▸ MAOB P27338 3/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ MAPK14 Q16539 4/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ BACE1 P56817 1/20 0.32
▸ AMY1A P0DUB6 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ DHODH Q02127 1/20 0.31
▸ PDK1 Q15118 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAP4K4 O95819 1/20 0.30
▸ PDE10A Q9Y233 1/20 0.30

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
SCHEMBL31538921 1.00 MAPT (0.34) MAPTMAOBESR1ESR2MAPK14
SCHEMBL27033331 0.93 MAPT (0.36) MAPTMAOBESR1ESR2BACE1
SCHEMBL25520053 0.84 ESR1 (0.43) MAPTMAOBESR1ESR2BACE1
SCHEMBL27033294 0.83 MAOB (0.33) MAPTMAOBESR1ESR2BACE1
SCHEMBL30726161 0.83 MAOB (0.33) MAPTMAOBESR1ESR2BACE1
SCHEMBL25522215 0.81 ESR1 (0.40) MAPTMAOBESR1ESR2BACE1
SCHEMBL27033332 0.76 MAOB (0.35) MAPTMAOBESR1ESR2BACE1
SCHEMBL30726162 0.74 CA12 (0.45) MAPTMAP4K4
SCHEMBL27033384 0.74 CA12 (0.45) MAPTMAP4K4
SCHEMBL27033433 0.73 NPC1 (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4558478-A1 ARYL HYDROCARBON RECEPTOR AGONIST PRODRUGS AND METHODS OF USE THEREOF Allianthera (Suzhou) Biopharmaceutical Co., Ltd. (CN) 2025-05-28 — — EP claimed
WO-2024020170-A1 ARYL HYDROCARBON RECEPTOR AGONIST PRODRUGS AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2024-01-25 — — WO claimed
EP-4558478-A1 ARYL HYDROCARBON RECEPTOR AGONIST PRODRUGS AND METHODS OF USE THEREOF Allianthera (Suzhou) Biopharmaceutical Co., Ltd. (CN) 2025-05-28 — — EP disclosed
WO-2024020170-A1 ARYL HYDROCARBON RECEPTOR AGONIST PRODRUGS AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2024-01-25 — — WO disclosed
WO-2024020170-A1 ARYL HYDROCARBON RECEPTOR AGONIST PRODRUGS AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2024-01-25 — — WO disclosed
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