SCHEMBL19301156

SCHEMBL19301156

O=[N+]([O-])c1ccccc1-c1ccc2c3c1ccc1c4c5ccccc5n(-c5ccccc5)c4cc(c13)n2-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.38
▸ KMT2A Q03164 6/20 0.38
▸ LMNA P02545 3/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ PKM P14618 1/20 0.37
▸ MPI P34949 1/20 0.36
▸ APOBEC3G Q9HC16 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ GUSB P08236 1/20 0.34
▸ F2 P00734 1/20 0.34
▸ C1R P00736 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ TUBB4A P04350 1/20 0.33
▸ TUBB P07437 1/20 0.33
▸ TUBA3C P0DPH7 1/20 0.33

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
SCHEMBL19301176 0.86 LMNA (0.32) MEN1KMT2ALMNAALDH1A1PKM
SCHEMBL19301158 0.84 CHEK1 (0.40) MEN1KMT2AALDH1A1TDP1MPI
SCHEMBL15834581 0.84 ALDH1A1 (0.39) MEN1KMT2ALMNAKDM4EL3MBTL1
SCHEMBL20595209 0.83 KDM4E (0.46) MEN1KMT2ALMNAKDM4EATM
SCHEMBL30562779 0.83 KDM4E (0.46) MEN1KMT2ALMNAKDM4EATM
SCHEMBL19301160 0.82 ALDH1A1 (0.40) MEN1KMT2ALMNAALDH1A1TDP1
SCHEMBL17841975 0.81 HPRT1 (0.45) MEN1KMT2ALMNAKDM4EATM
SCHEMBL15823170 0.76 ALDH1A1 (0.44) MEN1KMT2ALMNAKDM4EATM
SCHEMBL25557866 0.76 TDP1 (0.48) MEN1KMT2ALMNAKDM4EATM
SCHEMBL14756544 0.76 ALDH1A1 (0.50) MEN1KMT2ALMNAKDM4EATM

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
WO-2017146406-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2017-08-31 — — WO disclosed
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