SCHEMBL18132280

SCHEMBL18132280

NCOC(=O)c1nccc(Cl)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ ASPH Q12797 1/20 0.37
▸ KDM8 Q8N371 1/20 0.37
▸ SSTR4 P31391 1/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ KMO O15229 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ GBA1 P04062 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ AOC3 Q16853 1/20 0.32
▸ NPC1 O15118 1/20 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
SCHEMBL27267807 0.80 POLB (0.53) KDM4EL3MBTL1ALDH1A1TDP1NPSR1
SCHEMBL29918922 0.79 L3MBTL1 (0.45) KDM4EASPHKDM8SSTR4L3MBTL1
SCHEMBL2067513 0.79 L3MBTL1 (0.45) KDM4EASPHKDM8SSTR4L3MBTL1
SCHEMBL28200557 0.75 ATR (0.41) KDM4EASPHKDM8SSTR4ALDH1A1
SCHEMBL30990531 0.74 KDM4E (0.63) KDM4EASPHKDM8L3MBTL1ALDH1A1
SCHEMBL15060252 0.74 KDM4E (0.63) KDM4EASPHKDM8L3MBTL1ALDH1A1
SCHEMBL21561868 0.73 KDM4E (0.43) KDM4EASPHKDM8SSTR4ALDH1A1
SCHEMBL2065683 0.73 KDM4E (0.61) KDM4EASPHKDM8L3MBTL1ALDH1A1
SCHEMBL30605221 0.72 KDM4E (0.37) KDM4EASPHKDM8SSTR4ALDH1A1
SCHEMBL29122703 0.72 L3MBTL1 (0.37) L3MBTL1ALDH1A1GAAMAPTKMT2A

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
EP-3280715-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO [1, 5-a]PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES Beigene, Ltd. (KY) 2018-02-14 — — EP disclosed
WO-2016161960-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO [1, 5-a] PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES BEIGENE, LTD. (KY) 2016-10-13 — — WO disclosed
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