SCHEMBL29200344

SCHEMBL29200344

NC(=O)c1ccccc1OCc1ccc(NC(=O)Nc2cccc(Cl)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPIA P62937 3/20 0.65
PARP1 P09874 4/20 0.65
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
KDM4E B2RXH2 2/20 0.63
PARP2 Q9UGN5 2/20 0.62
LRRK2 Q5S007 3/20 0.55
NPC1 O15118 4/20 0.54
MAPT P10636 4/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 3/20 0.54
RAB9A P51151 3/20 0.54
CASP3 P42574 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
EGFR P00533 1/20 0.52
ALDH1A1 P00352 1/20 0.51
SGMS2 Q8NHU3 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL30802647 1.00 PPIA (0.65) PPIAPARP1MEN1KMT2AKDM4E
SCHEMBL30802656 0.92 PARP1 (0.76) PPIAPARP1MEN1KMT2AKDM4E
SCHEMBL29200327 0.92 PARP1 (0.76) PPIAPARP1MEN1KMT2AKDM4E
SCHEMBL29200362 0.88 PARP1 (0.66) PPIAPARP1MEN1KMT2AKDM4E
SCHEMBL30802625 0.87 PARP1 (0.85) PPIAPARP1MEN1KMT2APARP2
SCHEMBL29200328 0.87 PARP1 (0.65) PPIAPARP1MEN1KMT2APARP2
SCHEMBL29200326 0.87 PARP1 (0.85) PPIAPARP1MEN1KMT2APARP2
SCHEMBL30802630 0.87 PARP1 (0.65) PPIAPARP1MEN1KMT2APARP2
SCHEMBL30802654 0.87 PARP1 (0.65) PPIAPARP1MEN1KMT2APARP2
SCHEMBL29200330 0.87 PARP1 (0.65) PPIAPARP1MEN1KMT2APARP2

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-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 CN claimed
CN-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 CN disclosed