SCHEMBL29080440

SCHEMBL29080440

CC(=O)CC(=O)C1(N)C=CC(N)(C(=O)CC(C)=O)C=C1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KDM6B O15054 1/20 0.31
KDM5C P41229 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL29243303 0.69 LMNA (0.35)
Ammonia Solution, Strong SCHEMBL29243301 0.67 LMNA (0.33)
SCHEMBL12205739 0.66
Water SCHEMBL23701696 0.65 MGAM (0.50) MGAMGAASIMGAM2HTT
SCHEMBL2128645 0.64 MGAM (0.56) MGAMGAASIMGAM2HTT
SCHEMBL10389469 0.64 MGAM (0.56) MGAMGAASIMGAM2HTT
SCHEMBL1608 0.64
Benzene SCHEMBL28130689 0.62 KDM4E (0.48) MGAMGAASIMGAM2HTT
Water SCHEMBL4455753 0.62 MGAM (0.47) MGAMGAASIMGAM2HTT
SCHEMBL21404935 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115491051-A Preparation method and application of pigment yellow 155 德州学院 2022-12-20 CN claimed
CN-115491051-A Preparation method and application of pigment yellow 155 德州学院 2022-12-20 CN disclosed