SCHEMBL28973113

SCHEMBL28973113

Cc1ccc(S(=O)(=O)N2C/C(=C\c3ccc(Br)cc3)C(=O)c3ccccc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 2/20 0.57
▸ KCNA3 P22001 2/20 0.57
▸ MIF P14174 1/20 0.45
▸ MMP2 P08253 2/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ ERBB2 P04626 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ ACHE P22303 4/20 0.41
▸ DHODH Q02127 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CARM1 Q86X55 1/20 0.38
▸ CMA1 P23946 1/20 0.38

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
SCHEMBL29754973 1.00 KCNN4 (0.57) KCNN4KCNA3MIFMMP2DRD3
SCHEMBL28973111 0.91 KCNN4 (0.62) KCNN4KCNA3MIFMMP2ACHE
SCHEMBL29754844 0.91 KCNN4 (0.62) KCNN4KCNA3MIFMMP2ACHE
SCHEMBL29754934 0.87 KCNN4 (0.55) KCNN4KCNA3MIFMMP2ACHE
SCHEMBL28973132 0.87 KCNN4 (0.55) KCNN4KCNA3MIFMMP2ACHE
SCHEMBL28973159 0.82 KCNN4 (0.47) KCNN4KCNA3MIFACHEDHODH
SCHEMBL29754772 0.80 KCNN4 (0.57) KCNN4KCNA3MIFMMP2TP53
SCHEMBL28973105 0.80 KCNN4 (0.57) KCNN4KCNA3MIFMMP2TP53
SCHEMBL29754785 0.79 MMP2 (0.47) KCNN4KCNA3MIFMMP2LMNA
SCHEMBL28973103 0.79 MMP2 (0.47) KCNN4KCNA3MIFMMP2LMNA

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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