SCHEMBL28777918

SCHEMBL28777918

CCCOC(=S)N(N)CCC

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
HPGD P15428 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 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
SCHEMBL1701165 0.77 CA12 (0.48) CA12CA1CA2CA9HPGD
SCHEMBL17764216 0.75 CA12 (0.41) CA12CA1CA2CA9HPGD
SCHEMBL9715892 0.74 CA12 (0.44) CA12CA1CA2CA9HPGD
SCHEMBL11347405 0.72
SCHEMBL29467086 0.70 CA12 (0.50) CA12CA1CA2CA9HPGD
SCHEMBL11043128 0.70 CHRNB2 (0.47) CA12CA1CA2CA9HPGD
SCHEMBL14724314 0.69
SCHEMBL1488882 0.69
SCHEMBL8772643 0.68 ALDH1A1 (0.42) CA12CA1CA2CA9HPGD
SCHEMBL28502704 0.68 EHMT2 (0.34) CA12CA1CA2CA9HPGD

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-114685334-A Preparation method of prosulfocarb 南通泰禾化工股份有限公司 2022-07-01 CN claimed
CN-114685334-A Preparation method of prosulfocarb 南通泰禾化工股份有限公司 2022-07-01 CN disclosed