SCHEMBL29099754

SCHEMBL29099754

NC(=O)c1cccc(C(=O)Nc2cccnc2)c1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.69
HIF1A Q16665 1/20 0.69
NAMPT P43490 3/20 0.68
ALDH1A1 P00352 1/20 0.65
CYP11B1 P15538 4/20 0.62
CYP11B2 P19099 4/20 0.62
KCNK3 O14649 1/20 0.61
MAPT P10636 1/20 0.61
SIRT2 Q8IXJ6 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.60
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
TSHR P16473 1/20 0.58
MAPK1 P28482 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
SCHEMBL30533390 0.92 LMNA (0.81) LMNAHIF1ANAMPTALDH1A1CYP11B1
SCHEMBL22983139 0.88 KCNK3 (0.74) LMNAHIF1AALDH1A1KCNK3SIRT2
SCHEMBL7078083 0.85 LMNA (0.69) LMNAHIF1ANAMPTALDH1A1CYP11B1
SCHEMBL3646841 0.83 NT5E (0.68) LMNAALDH1A1KCNK3SIRT2L3MBTL1
SCHEMBL1571386 0.82 LMNA (1.00) LMNAHIF1ANAMPTCYP11B1CYP11B2
SCHEMBL617919 0.82 NAMPT (0.71) LMNAHIF1ANAMPTALDH1A1CYP11B1
SCHEMBL19663017 0.82 LMNA (0.69) LMNAHIF1ANAMPTALDH1A1CYP11B1
SCHEMBL31661935 0.82 BRAF (0.79) LMNAHIF1ANAMPTALDH1A1KCNK3
SCHEMBL23565666 0.82 BRAF (0.76) LMNAHIF1ANAMPTALDH1A1CYP11B1
SCHEMBL12979 0.82 BRAF (0.79) LMNAHIF1ANAMPTALDH1A1KCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116769179-A Coordination polymer containing isophthalic acid and preparation method thereof 中国科学院沈阳应用生态研究所 2023-09-19 CN claimed
CN-116769179-B Coordination polymer containing isophthalic acid and preparation method thereof 中国科学院沈阳应用生态研究所 2024-02-06 CN disclosed
CN-116769179-A Coordination polymer containing isophthalic acid and preparation method thereof 中国科学院沈阳应用生态研究所 2023-09-19 CN disclosed
CN-116606246-A Silver complex antibacterial agent with aromatic amide structure-containing nitrogen heterocyclic derivative as ligand, and preparation method and application thereof 烟台哈尔滨工程大学研究院 2023-08-18 CN disclosed