SCHEMBL29001067

SCHEMBL29001067

O=C(C(CO)c1cnc(Cl)s1)C(CO)c1cnc(Cl)s1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
ALOX12 P18054 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KMT2A Q03164 3/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PYGL P06737 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
SCHEMBL27708191 0.74 CDK2 (0.38) L3MBTL1SMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL29001068 0.74 L3MBTL1 (0.32) L3MBTL1SMN1; SMN2KDM4ESLC6A3KMT2A
SCHEMBL20093614 0.69 L3MBTL1 (0.38) L3MBTL1ALDH1A1SLC6A3KMT2ALMNA
SCHEMBL28364931 0.68 L3MBTL1 (0.42) L3MBTL1SMN1; SMN2KDM4EALDH1A1ALOX12
SCHEMBL16795817 0.67 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2ALDH1A1SLC6A3KMT2A
SCHEMBL28364933 0.67 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2ALDH1A1SLC6A3KMT2A
SCHEMBL28369153 0.67 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2ALDH1A1SLC6A3KMT2A
SCHEMBL29015079 0.67 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2ALDH1A1SLC6A3KMT2A
SCHEMBL28897438 0.67
SCHEMBL28447284 0.67 TAAR1 (0.35) L3MBTL1KDM4ESLC6A3KMT2ALMNA

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-116102580-A Pyrimidinium compounds and mixtures thereof for combating animal pests 巴斯夫欧洲公司 2023-05-12 CN disclosed
CN-116082366-A Pyrimidinium compounds and mixtures thereof for combating animal pests 巴斯夫欧洲公司 2023-05-09 CN disclosed
CN-116076518-A Pyrimidinium compounds and mixtures thereof for combating animal pests 巴斯夫欧洲公司 2023-05-09 CN disclosed