SCHEMBL28829404

SCHEMBL28829404

NC(=O)c1ccc(C(=O)Nc2ccncc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.81
L3MBTL1 Q9Y468 1/20 0.81
GAA P10253 1/20 0.69
KMT2A Q03164 4/20 0.69
NT5E P21589 1/20 0.69
JAK2 O60674 1/20 0.68
TYK2 P29597 1/20 0.68
POLB P06746 3/20 0.66
MAPT P10636 3/20 0.66
STAT3 P40763 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
ROCK2 O75116 3/20 0.64
ROCK1 Q13464 3/20 0.64
HTT P42858 1/20 0.62
MAPK1 P28482 2/20 0.59
MEN1 O00255 2/20 0.58
LMNA P02545 1/20 0.58
ALDH1A1 P00352 1/20 0.58
PKM P14618 1/20 0.58
NAMPT P43490 1/20 0.58

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
SCHEMBL27880186 0.95 POLB (0.73) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL3093554 0.95 GAA (0.79) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL14716526 0.90 KDM4E (1.00) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL1898755 0.86 GAA (0.91) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL13210699 0.86 KMT2A (0.73) KDM4EL3MBTL1GAAKMT2APOLB
SCHEMBL11613305 0.85 POLB (0.87) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL3462289 0.85 MDM2 (0.70) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL19241698 0.85 KDM4E (0.88) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL23999623 0.83 KDM4E (0.85) KDM4EL3MBTL1GAAKMT2ANT5E
SCHEMBL23096186 0.83 KDM4E (0.85) KDM4EL3MBTL1GAAKMT2ANT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835915-B Camphoric acid-based chiral coordination porous framework material and preparation method and application thereof 合肥工业大学 2023-08-01 CN claimed
CN-114835915-A Camphor acid based chiral coordination porous framework material and preparation method and application thereof 合肥工业大学 2022-08-02 CN claimed
CN-114835915-B Camphoric acid-based chiral coordination porous framework material and preparation method and application thereof 合肥工业大学 2023-08-01 CN disclosed
CN-114835915-B Camphoric acid-based chiral coordination porous framework material and preparation method and application thereof 合肥工业大学 2023-08-01 CN disclosed
CN-114835915-A Camphor acid based chiral coordination porous framework material and preparation method and application thereof 合肥工业大学 2022-08-02 CN disclosed