SCHEMBL28820358

SCHEMBL28820358

COc1cc(OC)nc(Sc2cccc(Cl)c2C(=O)O/N=C/c2ccc(C)cc2)n1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
CASP3 P42574 1/20 0.45
KMT2A Q03164 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL28820346 0.93 POLB (0.39) KMT2AALDH1A1HPGD
SCHEMBL28820352 0.92 CYP2C19 (0.40) MAPTALDH1A1HPGD
SCHEMBL29795090 0.91 MAPT (0.39) MAPTCASP3KMT2ASENP8SENP7
SCHEMBL28820344 0.91 PLA2G7 (0.43) MAPTCASP3KMT2ASENP8SENP7
SCHEMBL28820321 0.91 MAPT (0.46) MAPTKMT2A
SCHEMBL28820341 0.91 MAPT (0.39) MAPTCASP3KMT2ASENP8SENP7
SCHEMBL28820338 0.88 CA12 (0.44)
SCHEMBL28820348 0.88 ALOX5 (0.40) MAPT
SCHEMBL28820326 0.87 ALDH1A1 (0.41) MAPTALDH1A1HPGDKDM4E
SCHEMBL28820349 0.86 MEN1 (0.43) MAPTKMT2AALDH1A1HPGD

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-114773276-B Pyrithiobac-sodium aldoxime ester herbicide and preparation method thereof 常州大学 2023-07-25 CN claimed
CN-114773276-A Pyriminosulfether aldoxime ester herbicide and preparation method thereof 常州大学 2022-07-22 CN claimed
CN-114773276-B Pyrithiobac-sodium aldoxime ester herbicide and preparation method thereof 常州大学 2023-07-25 CN disclosed
CN-114773276-A Pyriminosulfether aldoxime ester herbicide and preparation method thereof 常州大学 2022-07-22 CN disclosed