SCHEMBL30957392

SCHEMBL30957392

CN(C)C=CC(=O)c1ccc([N+](=O)[O-])c(F)c1O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.50
▸ ALDH1A1 P00352 7/20 0.50
▸ GAA P10253 3/20 0.45
▸ HTT P42858 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ RECQL P46063 2/20 0.39
▸ HPGD P15428 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ POLB P06746 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL28999961 0.80 MAPT (0.53) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL30957331 0.76 GPR35 (0.41) MAPTALDH1A1RAB9ATDP1RECQL
SCHEMBL29744419 0.76 ALDH1A1 (0.55) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL4464211 0.76 ALDH1A1 (0.55) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL4464214 0.76 ALDH1A1 (0.55) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL2463665 0.74 MAPT (0.60) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL15103245 0.74 ALDH1A1 (0.53) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL2463662 0.74 MAPT (0.60) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL26192826 0.74 ALDH1A1 (0.60) MAPTALDH1A1GAAHTTRAB9A
SCHEMBL15103246 0.74 ALDH1A1 (0.53) MAPTALDH1A1GAAHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598933-A1 PHOSPHORAMIDATE COMPOUNDS AND USES THEREOF Allorion Therapeutics Inc (US) 2025-08-13 — — EP disclosed
CN-119968377-A Phosphoramidate compounds and uses thereof 安锐生物医药公司 2025-05-09 — — CN disclosed
WO-2024078392-A1 PHOSPHORAMIDATE COMPOUNDS AND USES THEREOF ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO., LTD. (CN) 2024-04-18 — — WO disclosed
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