SCHEMBL28898207

SCHEMBL28898207

CC(N)OS(=O)(=O)c1ccccc1.[NaH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
PLA2G7 Q13093 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
HTR6 P50406 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
PARL Q9H300 1/20 0.39
PSIP1 O75475 1/20 0.39
LARS1 Q9P2J5 1/20 0.38
ALDH1A1 P00352 6/20 0.38
MAPT P10636 4/20 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
SCHEMBL6880747 0.98 CA12 (0.43) CA12CA1CA2CA3CA4
SCHEMBL1147676 0.83 HTR6 (0.42) CA12CA1CA2CA3CA4
SCHEMBL14778409 0.83 HTR6 (0.46) CA12CA1CA2CA3CA4
Water SCHEMBL27733359 0.82 HTR6 (0.41) CA12CA1CA2CA3CA4
SCHEMBL780154 0.81 HTR6 (0.44) CA12CA1CA2CA3CA4
SCHEMBL28456593 0.80 SMN1; SMN2 (0.41) CA1CA2HTR6TDP1PARL
SCHEMBL7008174 0.80 CA1 (0.48) CA12CA1CA2CA3CA6
SCHEMBL14780300 0.79 HTR6 (0.42) CA12CA1CA2CA3CA4
SCHEMBL14779395 0.79 HTR6 (0.42) CA12CA1CA2CA3CA4
Lithium SCHEMBL31518227 0.79 HTR6 (0.42) CA12CA1CA2CA3CA4

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-111534265-B Ionic polyurethane hot melt adhesive foam product and preparation method thereof 美瑞新材料股份有限公司 2021-11-30 CN disclosed
CN-111534265-A Ionic polyurethane hot melt adhesive foam product and preparation method thereof 美瑞新材料股份有限公司 2020-08-14 CN disclosed