SCHEMBL19971239

SCHEMBL19971239

C=CC(=O)NC[N+](CCCC)(CCCC)C(C)CCS(=O)(=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
EPHX2 P34913 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
GRK2 P25098 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL19971183 0.93 ZDHHC20 (0.34) ZDHHC20ZDHHC2
SCHEMBL19971242 0.89 ZDHHC20 (0.47) ZDHHC20ZDHHC2EPHX2MEN1LMNA
SCHEMBL19971221 0.87 ZDHHC20 (0.33) ZDHHC20ZDHHC2
SCHEMBL19971324 0.84 ZDHHC20 (0.43) ZDHHC20ZDHHC2EPHX2KMT2A
SCHEMBL19971179 0.83 TSHR (0.33) ZDHHC20ZDHHC2EPHX2MEN1LMNA
SCHEMBL19971192 0.83 ZDHHC20 (0.41) ZDHHC20ZDHHC2EPHX2KMT2A
SCHEMBL19971194 0.83 MEN1 (0.33) EPHX2MEN1LMNAPOLBGRK2
SCHEMBL19971335 0.79 TSHR (0.34) ZDHHC20ZDHHC2
SCHEMBL19971275 0.78 ZDHHC20 (0.43) ZDHHC20ZDHHC2EPHX2MEN1LMNA
SCHEMBL19971254 0.78 TSHR (0.40) MEN1LMNAPOLBGRK2KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530286-B2 Sulfobetaine-based protein aggregation inhibitor for use in preventing aggregation of a protein OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2022-12-20 US disclosed
US-10995160-B2 Protein aggregation inhibitor OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2021-05-04 US disclosed
US-20200332044-A1 PROTEIN AGGREGATION INHIBITOR OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2020-10-22 US disclosed
US-20190161563-A1 PROTEIN AGGREGATION INHIBITOR OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2019-05-30 US disclosed
US-20180118859-A1 PROTEIN AGGREGATION INHIBITOR OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2018-05-03 US disclosed
EP-3296314-A1 PROTEIN AGGREGATION INHIBITOR Osaka Organic Chemical Industry Ltd. (JP) 2018-03-21 EP disclosed