SCHEMBL28062052

SCHEMBL28062052

O=S(=O)(On1ccnc1)c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.38
PGR P06401 1/20 0.38
HTR6 P50406 4/20 0.37
F2 P00734 2/20 0.37
PRSS1 P07477 2/20 0.37
PRSS2 P07478 2/20 0.37
PRSS3 P35030 2/20 0.37
TSHR P16473 2/20 0.36
AKR1B1 P15121 1/20 0.36
CYP17A1 P05093 1/20 0.35
CYP26A1 O43174 1/20 0.35

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
SCHEMBL28072374 0.79 GAA (0.42) CA1CA2CA9POLBMEN1
SCHEMBL28062046 0.77 POLB (0.39) POLBMEN1KMT2ATSHRCYP17A1
SCHEMBL28122072 0.76 TTR (0.39)
SCHEMBL27671484 0.75 PARL (0.46) MEN1KMT2AHTT
SCHEMBL28062013 0.75 HTR6 (0.42) CA1CA2CA9MEN1KMT2A
SCHEMBL28148247 0.71 KDM4E (0.47) POLBMEN1KMT2A
SCHEMBL6662437 0.71 CA1 (0.57) CA1CA2CA9MEN1KMT2A
SCHEMBL31286100 0.70 CA1 (0.61) CA1CA2CA9MEN1KMT2A
SCHEMBL2323729 0.70 CA1 (0.61) CA1CA2CA9MEN1KMT2A
1-Methylimidazole SCHEMBL17961176 0.70 NFKB1 (0.42) CA1CA2CA9POLBMEN1

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-105531298-A Monomer liquid for production of conductive polymer and method for manufacturing electrolytic capacitor using same TAYCA CORP 2016-04-27 CN disclosed