SCHEMBL28030772

SCHEMBL28030772

O=S(=O)(CCl)Oc1ccc(-c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.58
CA1 P00915 5/20 0.58
CA9 Q16790 5/20 0.58
KMT2A Q03164 2/20 0.48
CA12 O43570 5/20 0.44
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BACE1 P56817 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
APEX1 P27695 1/20 0.39
MMP2 P08253 1/20 0.38
MMP7 P09237 1/20 0.38
MMP14 P50281 1/20 0.38
PARL Q9H300 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
SCHEMBL6252538 0.88 KMT2A (0.61) CA2CA1CA9KMT2AHTT
SCHEMBL2058473 0.82 CA2 (0.60) CA2CA1CA9KMT2ACA12
SCHEMBL28377723 0.77 CA2 (0.69) CA2CA1CA9KMT2ACA12
SCHEMBL23930791 0.76 PARP10 (0.53) CA9KMT2ACA12TDP1MEN1
SCHEMBL23931022 0.76 GAA (0.41) CA2CA1CA9KMT2ACA12
SCHEMBL3281693 0.75 CA2 (0.51) CA2CA1CA9KMT2ACA12
SCHEMBL19096219 0.74 CA2 (0.64) CA2CA1CA9KMT2ACA12
SCHEMBL7263619 0.74 CA2 (1.00) CA2CA1CA9CA12
SCHEMBL8746892 0.74 CA2 (0.64) CA2CA1CA9KMT2ACA12
SCHEMBL2058243 0.74 CA2 (0.64) CA2CA1CA9KMT2ACA12

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-105008378-B The manufacturing method of cross-coupling catalysts and aromatic compound 北兴化学工业株式会社 2018-05-18 CN disclosed
CN-105008378-A Reaction catalyst for cross coupling and method for manufacturing aromatic compound HOKKO CHEM IND CO 2015-10-28 CN disclosed