SCHEMBL27792385

SCHEMBL27792385

O=C(O)COc1ccc2ccccc2c1N=Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.57
▸ TDP1 Q9NUW8 3/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ HPGD P15428 1/20 0.57
▸ THRB P10828 3/20 0.54
▸ CTSD P07339 1/20 0.47
▸ MAPT P10636 6/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ PKM P14618 1/20 0.45
▸ L3MBTL1 Q9Y468 4/20 0.44
▸ RECQL P46063 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ALPL P05186 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ ALPI P09923 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ ALPG P10696 1/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ MMP14 P50281 1/20 0.44

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
SCHEMBL27813705 0.84 CNR2 (0.55) ALDH1A1TDP1KDM4ETHRBMAPT
SCHEMBL25811431 0.80 THRB (0.53) ALDH1A1TDP1KDM4EHPGDTHRB
SCHEMBL7825919 0.79 THRB (0.63) ALDH1A1TDP1KDM4EHPGDTHRB
SCHEMBL7825916 0.79 THRB (0.63) ALDH1A1TDP1KDM4EHPGDTHRB
SCHEMBL23964328 0.78 THRB (0.61) ALDH1A1TDP1KDM4ETHRBMAPT
SCHEMBL26172965 0.77 THRB (0.50) ALDH1A1TDP1KDM4ETHRBMAPT
SCHEMBL23930168 0.77 THRB (0.50) ALDH1A1TDP1KDM4ETHRBMAPT
SCHEMBL22169441 0.77 ALDH1A1 (0.70) ALDH1A1TDP1KDM4EHPGDCTSD
SCHEMBL29506888 0.77 ALDH1A1 (0.70) ALDH1A1TDP1KDM4EHPGDCTSD
SCHEMBL14130418 0.77 MAPT (0.53) ALDH1A1TDP1KDM4ETHRBMAPT

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
CN-101839907-A Enzyme-liked immunosorbent assay method for sudan red I UNIV CHINA AGRICULTURAL 2010-09-22 — — CN claimed
CN-101839907-A Enzyme-liked immunosorbent assay method for sudan red I UNIV CHINA AGRICULTURAL 2010-09-22 — — CN disclosed
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