SCHEMBL30387779

SCHEMBL30387779

CO[Si](CCCNc1cccc(S(=O)(=O)O)c1)(OC)OC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
CA12 O43570 6/20 0.41
CA1 P00915 6/20 0.41
CA2 P00918 6/20 0.41
CA9 Q16790 6/20 0.41
CASR P41180 3/20 0.40
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
TNNI3K Q59H18 1/20 0.36

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
SCHEMBL29002333 0.83 MTNR1A (0.33) MTNR1AMTNR1BCA12CA1CA2
SCHEMBL9617384 0.79 MTNR1A (0.47) MTNR1AMTNR1BMAPTALDH1A1TSHR
SCHEMBL6449192 0.77 MAPT (0.61) MTNR1AMTNR1BMAPTSMN1; SMN2ALDH1A1
SCHEMBL959868 0.76 MTNR1A (0.43) MTNR1AMTNR1BMAPTKDM4EALDH1A1
SCHEMBL9627421 0.75 CA1 (0.47) CA12CA1CA2CA9CASR
SCHEMBL41158 0.75 MAPT (0.57) MTNR1AMTNR1BMAPTALDH1A1GAA
SCHEMBL28828211 0.75 MAPT (0.57) MTNR1AMTNR1BMAPTALDH1A1GAA
Acetone SCHEMBL9580358 0.75 ALDH1A1 (0.48) MTNR1AMTNR1BMAPTSMN1; SMN2KDM4E
SCHEMBL14682409 0.74 MAPT (0.51) MAPTSMN1; SMN2ALDH1A1TDP1GAA
Hydrochloric Acid SCHEMBL21813259 0.74 MAPT (0.55) MTNR1AMTNR1BMAPTALDH1A1GAA

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-115478435-B Water-based long-acting mildew preventive for fabrics and preparation method thereof 雅思汀娜(北京)科技有限公司 2023-05-23 CN claimed
CN-115478435-B Water-based long-acting mildew preventive for fabrics and preparation method thereof 雅思汀娜(北京)科技有限公司 2023-05-23 CN disclosed