SCHEMBL27784377

SCHEMBL27784377

NS(=O)(=O)NC1C[CH]CCC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.57
CA2 P00918 9/20 0.57
CA7 P43166 6/20 0.35
CA12 O43570 5/20 0.35
CA14 Q9ULX7 5/20 0.35
KDM4E B2RXH2 1/20 0.34
RECQL P46063 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA9 Q16790 3/20 0.32
CA3 P07451 3/20 0.32
CA6 P23280 3/20 0.32
CA5B Q9Y2D0 3/20 0.32
CA4 P22748 2/20 0.32
CA13 Q8N1Q1 2/20 0.32
CA5A P35218 1/20 0.32
CISD1 Q9NZ45 1/20 0.31

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
SCHEMBL28644749 0.80 CA12 (0.35) CA1CA2CA7CA12CA14
SCHEMBL3225545 0.79 CA1 (0.60) CA1CA2CA7CA12CA14
SCHEMBL29022573 0.78 CA1 (0.34) CA1CA2CA7CA12CA14
SCHEMBL5597122 0.77 CA1 (0.33) CA1CA2CA7CA12CA14
SCHEMBL73357 0.77 SMYD3 (0.37) CA1CA2CA7CA12CA14
SCHEMBL1644220 0.75
SCHEMBL1646471 0.75 CA1 (0.95) CA1CA2CA7CA12CA14
SCHEMBL22169773 0.73 CA1 (1.00) CA1CA2CA7CA12CA14
SCHEMBL964315 0.73 CA1 (1.00) CA1CA2CA7CA12CA14
SCHEMBL9069907 0.72 CA1 (0.95) CA1CA2CA7CA12CA14

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-110115365-A The adjusting that actinism receptor and relative ligand are carried out 西诺米克斯公司 2019-08-13 CN disclosed
CN-101779124-A modulation of chemosensory receptors and ligands associated therewith SENOMYX INC 2010-07-14 CN disclosed