SCHEMBL30174176

SCHEMBL30174176

Cc1ncc(C(N)=O)c(O)c1-c1ccco1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ ADORA3 P0DMS8 6/20 0.38
▸ ADORA2A P29274 5/20 0.38
▸ ADORA1 P30542 5/20 0.38
▸ ADORA2B P29275 3/20 0.38
▸ IKBKB O14920 1/20 0.37
▸ POLB P06746 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ MYC P01106 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ NPSR1 Q6W5P4 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
SCHEMBL25529069 0.87 L3MBTL1 (0.47) L3MBTL1ADORA3ADORA2AADORA1POLB
SCHEMBL30174268 0.87 L3MBTL1 (0.47) L3MBTL1ADORA3ADORA2AADORA1POLB
SCHEMBL28966253 0.79 ALDH1A1 (0.42) L3MBTL1POLBTDP1ALDH1A1GLA
SCHEMBL30174280 0.77 IKBKB (0.43) L3MBTL1ADORA2BIKBKBTDP1ALDH1A1
SCHEMBL30174251 0.77 L3MBTL1 (0.57) L3MBTL1ADORA3ADORA1IKBKBPOLB
SCHEMBL30174256 0.76 ALOX5 (0.37) L3MBTL1POLBTDP1ALDH1A1GLA
SCHEMBL30174255 0.75 SLC2A1 (0.38) POLBTDP1
SCHEMBL30174236 0.75 EEF2K (0.38) L3MBTL1POLBTDP1ALDH1A1GLA
SCHEMBL18920575 0.73 KEAP1 (0.44) L3MBTL1IKBKBPOLBTDP1CTDSP1
SCHEMBL29812284 0.72 LMNA (0.44) IKBKBTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115605478-A Compounds and methods of use 埃克塞里艾克西斯公司(US) 2023-01-13 — — CN disclosed
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