SCHEMBL8622333

SCHEMBL8622333

Nc1ccccc1NOc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.48
▸ KDM4E B2RXH2 5/20 0.48
▸ GAA P10253 5/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ TDP1 Q9NUW8 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ MMP14 P50281 1/20 0.42
▸ HDAC3 O15379 7/20 0.41
▸ HDAC1 Q13547 7/20 0.41
▸ HDAC2 Q92769 7/20 0.41

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
SCHEMBL28072152 0.74 MAPT (0.39) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL2356967 0.73 MAPT (0.48) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL10978305 0.71 ALDH1A1 (0.52) MAPTKDM4EGAAALDH1A1KMT2A
SCHEMBL8622331 0.70 MAPT (0.52) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL13639779 0.70 MAPT (0.46) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL28957585 0.70 MAPT (0.43) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL26803231 0.70 MAPT (0.43) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL251644 0.69 ALDH1A1 (0.43) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL3977426 0.68 MAPT (0.68) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL11699661 0.68 ALDH1A1 (0.45) MAPTKDM4EGAAALDH1A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10045690-A — — None — — JP disclosed
JP-H1045690-A BIS-SUBSTITUTED PHENOXYPHENYLENEDIAMINE DERIVATIVE AND PRODUCTION THEREOF NISSAN CHEM IND LTD 1998-02-17 — — JP disclosed
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