SCHEMBL28162233

SCHEMBL28162233

Nc1cnccc1NC=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KDM6B O15054 1/20 0.41
▸ KDM4A O75164 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KDM4D Q6B0I6 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ AOC1 P19801 2/20 0.39
▸ AOC3 Q16853 2/20 0.39
▸ CA12 O43570 3/20 0.38
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CA9 Q16790 3/20 0.38

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
SCHEMBL28214123 0.84 GAA (0.42) ALDH1A1KDM4EMAPTMEN1KDM6B
SCHEMBL9207139 0.81 CA12 (0.37) ALDH1A1KDM4CAOC1AOC3CA12
SCHEMBL14361044 0.76 PTGS1 (0.37) KDM4CTDP1L3MBTL1CA12CA1
SCHEMBL19943717 0.74 AOC1 (0.35) ALDH1A1KDM4EMAPTMEN1KDM6B
SCHEMBL9330010 0.74 — —
SCHEMBL30074192 0.72 — —
SCHEMBL2046959 0.72 — —
SCHEMBL25297060 0.72 KDM4C (0.34) ALDH1A1KDM6BKDM4DKDM4CAOC1
SCHEMBL18857496 0.72 CA12 (0.46) ALDH1A1KDM4EMAPTMEN1KDM6B
SCHEMBL28866140 0.72 PTGS1 (0.41) MAPTKDM4CTDP1AOC1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117756718-A Preparation method of high-yield 3-amino-4-formamido pyrazole hemisulfate 宜兴市星宇药业有限公司 2024-03-26 — — CN claimed
CN-117756718-A Preparation method of high-yield 3-amino-4-formamido pyrazole hemisulfate 宜兴市星宇药业有限公司 2024-03-26 — — CN disclosed
CN-115353508-A 5-pyridine-1H-indazole compound, pharmaceutical composition and application 中国药科大学 2022-11-18 — — CN disclosed
CN-110167926-A POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS 米托布里奇公司 2019-08-23 — — CN disclosed
CN-107205391-A Histone demethylase inhibitors 赛尔基因昆蒂赛尔研究公司 2017-09-26 — — CN disclosed
CN-107001358-A Adjust the new pyridine hepyramine compound of istone lysine demethylase (KDM) catalytic activity 东亚ST株式会社 2017-08-01 — — CN disclosed
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