SCHEMBL9476076

SCHEMBL9476076

CC(=O)Nc1ccc(C=Cc2ccc([N+](=O)[O-])cc2S(=O)(=O)O)cc1.[NaH]

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.58
▸ KMT2A Q03164 5/20 0.52
▸ ALDH1A1 P00352 3/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ MAPT P10636 6/20 0.48
▸ THRB P10828 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ GAA P10253 3/20 0.44
▸ PKM P14618 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ POLB P06746 1/20 0.43

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
SCHEMBL9356922 0.99 ENPP2 (0.59) ENPP2KMT2AALDH1A1MEN1KDM4E
SCHEMBL9356916 0.99 ENPP2 (0.59) ENPP2KMT2AALDH1A1MEN1KDM4E
SCHEMBL9476066 0.98 ENPP2 (0.58) ENPP2KMT2AALDH1A1MEN1KDM4E
SCHEMBL9476072 0.89 APEX1 (0.56) ENPP2KMT2AALDH1A1MEN1KDM4E
SCHEMBL26725600 0.86 CD40 (0.53) KMT2AALDH1A1MEN1KDM4ETDP1
SCHEMBL9360466 0.84 PTGS2 (0.56) KMT2AALDH1A1MEN1MAPTNPC1
SCHEMBL1399781 0.84 PTGS2 (0.56) KMT2AALDH1A1MEN1MAPTNPC1
SCHEMBL26725596 0.82 SNCA (0.60) KMT2AALDH1A1MEN1MAPTHSP90AA1
SCHEMBL8653989 0.82 RAD51 (0.55) ENPP2KMT2AALDH1A1MEN1CYP3A4
SCHEMBL7744489 0.82 RAD51 (0.55) ENPP2KMT2AALDH1A1MEN1CYP3A4

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
US-5272259-A Stilbene dyestuffs and light-polarizing films or sheets containing stilbene BAYER AKTIENGESELLSCHAFT (DE) 1993-12-21 — — US disclosed
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