SCHEMBL28457652

SCHEMBL28457652

O=Nc1cccc(C=NO)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ KMT2A Q03164 5/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA7 P43166 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ FURIN P09958 1/20 0.38
▸ GFER P55789 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ CHRM5 P08912 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2D6 P10635 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ GRM5 P41594 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
SCHEMBL5666139 0.82 KDM4E (0.58) KDM4EALDH1A1L3MBTL1KMT2AFURIN
SCHEMBL5666137 0.82 KDM4E (0.58) KDM4EALDH1A1L3MBTL1KMT2AFURIN
SCHEMBL878514 0.78 ALDH1A1 (0.50) KDM4EALDH1A1CA1CA2CA7
SCHEMBL1109096 0.77 ALDH1A1 (0.36) KDM4EALDH1A1L3MBTL1KMT2ACA1
SCHEMBL23074232 0.77 CA1 (0.36) ALDH1A1L3MBTL1KMT2ACA1CA2
SCHEMBL10938534 0.77 ALDH1A1 (0.48) KDM4EALDH1A1L3MBTL1KMT2ACA1
SCHEMBL10955309 0.77 TDP1 (0.48) ALDH1A1L3MBTL1KMT2ACA1CA2
SCHEMBL16130510 0.75 NFE2L2 (0.50) ALDH1A1MAPK1CYP1A2LMNA
SCHEMBL4283272 0.74 GFER (0.56) KDM4EALDH1A1L3MBTL1KMT2ACA2
SCHEMBL3081450 0.74 GFER (0.56) KDM4EALDH1A1L3MBTL1KMT2ACA2

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-106371240-B Display device and polarizer thereof 乐金显示有限公司 2020-09-08 — — CN disclosed
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