SCHEMBL28897243

SCHEMBL28897243

O=C(O)CNC(=O)c1cnc(NCc2ccc(Oc3ccccc3)cc2)nc1O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 9/20 0.50
▸ KDM4C Q9H3R0 1/20 0.47
▸ CASR P41180 2/20 0.46
▸ THRA P10827 7/20 0.45
▸ THRB P10828 7/20 0.45
▸ FFAR1 O14842 1/20 0.45
▸ FFAR4 Q5NUL3 1/20 0.45
▸ BBOX1 O75936 1/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ ASPH Q12797 1/20 0.44
▸ KDM8 Q8N371 1/20 0.44
▸ FTO Q9C0B1 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ MAPK8 P45983 1/20 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
SCHEMBL30345304 1.00 EGLN1 (0.50) EGLN1KDM4CCASRTHRATHRB
SCHEMBL30345445 0.88 HDAC3 (0.53) EGLN1KDM4CFFAR1FTORAB9A
SCHEMBL28446135 0.88 HDAC3 (0.53) EGLN1KDM4CFFAR1FTORAB9A
SCHEMBL30345516 0.86 EGLN1 (0.48) EGLN1THRATHRBBBOX1SLC6A2
SCHEMBL28449008 0.86 EGLN1 (0.48) EGLN1THRATHRBBBOX1SLC6A2
SCHEMBL30345507 0.85 EGLN1 (0.50) EGLN1THRATHRBBBOX1SLC6A2
SCHEMBL28442664 0.85 EGLN1 (0.50) EGLN1THRATHRBBBOX1SLC6A2
SCHEMBL30345395 0.84 HDAC3 (0.50) EGLN1
SCHEMBL28448361 0.84 HDAC3 (0.50) EGLN1
SCHEMBL28449287 0.83 EGLN1 (0.52) EGLN1THRATHRBBBOX1SLC6A2

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
CN-111559982-A 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2020-08-21 — — CN claimed
CN-111559982-B 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2023-04-07 — — CN disclosed
CN-111559982-A 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2020-08-21 — — CN disclosed
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