SCHEMBL28299380

SCHEMBL28299380

CN(C)c1ccc(C2=NN(c3cccc(F)c3)C(=O)C(C(=O)O)C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PKM P14618 2/20 0.39
NT5E P21589 1/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
MAOB P27338 2/20 0.38
CACNA1H O95180 2/20 0.38
MAOA P21397 1/20 0.38
NR3C2 P08235 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL30187452 0.89 KMT2A (0.45) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL19660161 0.89 KMT2A (0.45) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL28873447 0.85 KDM4E (0.51) MEN1KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL28297925 0.84 CACNA1H (0.39) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL28299533 0.82 KDM4E (0.41) MEN1KMT2AKDM4EALDH1A1NT5E
SCHEMBL28297923 0.82 MEN1 (0.41) MEN1KMT2AKDM4EPDE4APDE4B
SCHEMBL19642564 0.77 HPGD (0.44) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL30187431 0.77 HPGD (0.44) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL28299379 0.77 MAOB (0.41) MEN1KMT2AKDM4EALDH1A1MAOB
SCHEMBL28297928 0.77 NT5E (0.35) KDM4EALDH1A1NT5EPDE4APDE4B

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-A 3- oxo -2,6- diphenyl -2,3- dihydrogen dazin -4- formamide 拜耳医药股份有限公司 2019-06-07 CN disclosed