SCHEMBL28319248

SCHEMBL28319248

NCNc1ccccc1OB(O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2C P18825 1/20 0.35
▸ CHRM2 P08172 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.32
▸ THRB P10828 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ENPP2 Q13822 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ CA12 O43570 1/20 0.30
▸ CA3 P07451 1/20 0.30
▸ CA4 P22748 1/20 0.30
▸ CA6 P23280 1/20 0.30
▸ CA5A P35218 1/20 0.30
▸ CA7 P43166 1/20 0.30

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
SCHEMBL27764586 0.80 KDM4E (0.46) CHRM2TDP1MAPTHTTKDM4E
SCHEMBL27764590 0.79 APP (0.42) TDP1MAPTHTTKDM4EENPP2
SCHEMBL29706601 0.72 ENPP2 (0.44) TDP1MAPTHTTENPP2MEN1
SCHEMBL6678412 0.72 ENPP2 (0.44) TDP1MAPTHTTENPP2MEN1
SCHEMBL28092250 0.71 PNMT (0.40) MAPTKDM4EENPP2LMNAGAA
SCHEMBL20296892 0.71 ENPP2 (0.38) MAPTHTTENPP2CA1CA2
SCHEMBL29169647 0.70 TSHR (0.56) MAPTHTTMEN1KMT2ALMNA
SCHEMBL30634538 0.69 ALDH1A1 (0.56) HTTKDM4EKMT2ALMNA
SCHEMBL28112456 0.68 KEAP1 (0.47) KDM4EMEN1KMT2AGAA
SCHEMBL5362698 0.67 MAPT (0.53) TDP1THRBMAPTHTTKDM4E

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-110121561-A Near-infrared glucose sensor 普罗菲尤萨股份有限公司 2019-08-13 — — CN disclosed
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