SCHEMBL28337295

SCHEMBL28337295

O=C(OO)c1ccc2ccc3ccccc3c2n1.[BeH2]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PIM1 P11309 1/20 0.42
MAPT P10636 3/20 0.40
PTGER4 P35408 1/20 0.40
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SIRT3 Q9NTG7 1/20 0.37
HTT P42858 1/20 0.37
GRM2 Q14416 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL14690237 0.80 KDM4E (0.46) KMT2AKDM4EMAPK1L3MBTL1PIM1
SCHEMBL7036195 0.79 KDM4E (0.62) KMT2AKDM4EMAPTMEN1RAB9A
SCHEMBL30937996 0.77 ALDH1A1 (0.47) KMT2AKDM4EMAPK1L3MBTL1PIM1
SCHEMBL3340090 0.77 ALDH1A1 (0.47) KMT2AKDM4EMAPK1L3MBTL1PIM1
SCHEMBL19645283 0.77 MAPT (0.54) KMT2AKDM4EMAPK1L3MBTL1MAPT
SCHEMBL6594652 0.77 BACE1 (0.47) KMT2AKDM4EPIM1MAPTHDAC8
SCHEMBL1512826 0.76 KDM4E (0.42) KMT2AKDM4EMAPK1L3MBTL1PIM1
SCHEMBL5176927 0.75 MGAM (0.63) KMT2AKDM4EL3MBTL1MAPTMEN1
SCHEMBL28908992 0.74 MAPT (0.61) KMT2AKDM4EL3MBTL1MAPTMEN1
SCHEMBL27643442 0.74 MAPT (0.61) KMT2AKDM4EL3MBTL1MAPTMEN1

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-108029176-B Method for manufacturing organic electronic device and method for manufacturing sealing member 住友化学株式会社 2019-12-13 CN disclosed