Alcohol

Alcohol

SCHEMBL29102443

CCO.O=[N+]([O-])c1cccnc1F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MAPT P10636 8/20 0.49
MAPK1 P28482 3/20 0.49
PDE10A Q9Y233 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
POLB P06746 2/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
LMNA P02545 4/20 0.46
KDM4E B2RXH2 3/20 0.46
IDO1 P14902 2/20 0.46
TDO2 P48775 2/20 0.46
CASP6 P55212 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
THRB P10828 1/20 0.46
PKM P14618 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
PAX8 Q06710 1/20 0.43
NPC1 O15118 3/20 0.43

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
SCHEMBL251800 0.89 PDE10A (0.56) ALDH1A1MAPTMAPK1PDE10AL3MBTL1
SCHEMBL29508937 0.89 PDE10A (0.56) ALDH1A1MAPTMAPK1PDE10AL3MBTL1
Formic Acid Methyl Ester SCHEMBL29210524 0.81 ALDH1A1 (0.48) ALDH1A1MAPTMAPK1PDE10AL3MBTL1
Alcohol SCHEMBL27548373 0.76 HSD17B10 (0.58) ALDH1A1L3MBTL1MEN1KMT2ALMNA
Alcohol SCHEMBL28728870 0.75 TDP1 (0.50) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL30425516 0.74 PDE10A (0.51) ALDH1A1MAPTMAPK1PDE10AL3MBTL1
SCHEMBL9986678 0.74 PDE10A (0.51) ALDH1A1MAPTMAPK1PDE10AL3MBTL1
SCHEMBL3769047 0.74 PDE10A (0.51) ALDH1A1MAPTPDE10AL3MBTL1POLB
SCHEMBL13748713 0.73 NAPRT (0.51) ALDH1A1PDE10AKMT2AKDM4ENPC1
SCHEMBL9640945 0.73 ALDH1A1 (0.50) ALDH1A1MAPTMAPK1PDE10AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117024334-A Synthesis method of 2-fluoro-3-hydroxypyridine 重庆医药高等专科学校 2023-11-10 CN claimed
CN-117024334-A Synthesis method of 2-fluoro-3-hydroxypyridine 重庆医药高等专科学校 2023-11-10 CN disclosed