SCHEMBL28973159

SCHEMBL28973159

Cc1ccc(/C=C2\CN(S(=O)(=O)c3ccccc3C)c3ccccc3C2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 1/20 0.47
▸ KCNA3 P22001 1/20 0.47
▸ MIF P14174 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.43
▸ ACHE P22303 4/20 0.42
▸ DHODH Q02127 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL29754844 0.83 KCNN4 (0.62) KCNN4KCNA3MIFACHEMEN1
SCHEMBL28973111 0.83 KCNN4 (0.62) KCNN4KCNA3MIFACHEMEN1
SCHEMBL28973113 0.82 KCNN4 (0.57) KCNN4KCNA3MIFACHEDHODH
SCHEMBL29754973 0.82 KCNN4 (0.57) KCNN4KCNA3MIFACHEDHODH
SCHEMBL28973132 0.80 KCNN4 (0.55) KCNN4KCNA3MIFACHEMEN1
SCHEMBL29754934 0.80 KCNN4 (0.55) KCNN4KCNA3MIFACHEMEN1
SCHEMBL29754853 0.78 ACHE (0.49) KCNN4KCNA3MIFACHEDHODH
SCHEMBL28973163 0.78 ACHE (0.49) KCNN4KCNA3MIFACHEDHODH
SCHEMBL28973105 0.73 KCNN4 (0.57) KCNN4KCNA3MIFMEN1KMT2A
SCHEMBL7336078 0.72 MEN1 (0.42) KCNN4KCNA3HSD17B10MEN1KMT2A

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-109836384-B Preparation method of 3-arylmethylene-2, 3-dihydro-4 (1H) -quinolinone 上海应用技术大学 2022-07-08 — — CN disclosed
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