SCHEMBL30174268

SCHEMBL30174268

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 6/20 0.47
▸ POLB P06746 6/20 0.47
▸ TDP1 Q9NUW8 5/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ PTPN1 P18031 3/20 0.44
▸ ADORA3 P0DMS8 4/20 0.44
▸ PTPN2 P17706 1/20 0.42
▸ PTPN6 P29350 1/20 0.42
▸ KDM4E B2RXH2 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ MAPT P10636 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ GAA P10253 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ PKM P14618 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ RCE1 Q9Y256 1/20 0.41
▸ ADORA2A P29274 3/20 0.41
▸ ADORA1 P30542 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41

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 1.00 L3MBTL1 (0.47) L3MBTL1POLBTDP1CTDSP1PTPN1
SCHEMBL30174176 0.87 L3MBTL1 (0.42) L3MBTL1POLBTDP1CTDSP1ADORA3
SCHEMBL25529098 0.76 KMT2A (0.39) L3MBTL1POLBTDP1KDM4EKMT2A
SCHEMBL25544889 0.75 PTPN1 (0.51) L3MBTL1POLBTDP1PTPN1ADORA3
SCHEMBL30367543 0.72 LMNA (0.45) KDM4EKMT2AMAPTALDH1A1MEN1
SCHEMBL18920540 0.71 MYC (0.53) L3MBTL1POLBTDP1CTDSP1PTPN1
SCHEMBL11780649 0.71 ADORA3 (0.51) L3MBTL1POLBTDP1ADORA3KDM4E
SCHEMBL25234719 0.70 DHODH (0.40) KDM4EKMT2AMAPTALDH1A1HPGD
SCHEMBL30174258 0.70 DHODH (0.40) KDM4EKMT2AMAPTALDH1A1HPGD
SCHEMBL30174280 0.70 IKBKB (0.43) L3MBTL1TDP1PTPN1PTPN2PTPN6

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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