SCHEMBL30187392

SCHEMBL30187392

COC(=O)C1CC(c2ccc(Cl)cc2)=NN(c2cccc(F)c2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ATM Q13315 1/20 0.42
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MAOB P27338 3/20 0.40
MAOA P21397 2/20 0.39
CACNA1H O95180 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PTGS2 P35354 2/20 0.39
AHR P35869 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 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
SCHEMBL19642470 1.00 MEN1 (0.42) MEN1KMT2AATMGAAMAPT
SCHEMBL19642676 0.92 MEN1 (0.41) MEN1KMT2AATMNPC1RAB9A
SCHEMBL19642640 0.92 KMT2A (0.44) MEN1KMT2AATMGAAMAPT
SCHEMBL30187436 0.92 KMT2A (0.44) MEN1KMT2AATMGAAMAPT
SCHEMBL30187431 0.91 HPGD (0.44) MEN1KMT2AMAPTPDE4APDE4B
SCHEMBL19642564 0.91 HPGD (0.44) MEN1KMT2AMAPTPDE4APDE4B
SCHEMBL19642520 0.90 EGFR (0.47) PDE4APDE4BPDE4CPDE4DCACNA1H
SCHEMBL30187411 0.90 EGFR (0.47) PDE4APDE4BPDE4CPDE4DCACNA1H
SCHEMBL30187468 0.90 EGFR (0.47) PDE4APDE4BPDE4CPDE4DCACNA1H
SCHEMBL30187464 0.90 KDM4E (0.48) MEN1KMT2APDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109863140-B 3-oxo-2, 6-diphenyl-2, 3-dihydropyridazine-4-carboxamide 拜耳医药股份有限公司 2023-02-21 CN disclosed