SCHEMBL28560997

SCHEMBL28560997

CN(C)CCCS(=O)(=O)O.[CH2]CC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.39
PTGS1 P23219 1/20 0.37
PDE4A P27815 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
DNM1 Q05193 4/20 0.36
PAOX Q6QHF9 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
LYPLA1 O75608 2/20 0.32
LYPLA2 O95372 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
EPHX2 P34913 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30

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
SCHEMBL128907 0.91 APP (0.46) APPPTGS1PDE4AALDH1A1TSHR
SCHEMBL5017073 0.89 APP (0.44) APPPTGS1PDE4AALDH1A1TSHR
Water SCHEMBL21226523 0.89 APP (0.44) APPPTGS1PDE4AALDH1A1TSHR
Hydrochloric Acid SCHEMBL3148714 0.89 APP (0.44) APPPTGS1PDE4AALDH1A1TSHR
Water SCHEMBL30397698 0.86 APP (0.42) APPPTGS1PDE4AALDH1A1TSHR
Hexadecane SCHEMBL26133982 0.85 DNM1 (0.56) ALDH1A1TSHRDNM1LYPLA1LYPLA2
Propanol SCHEMBL1271202 0.85 DNM1 (0.39) APPPTGS1PDE4AALDH1A1TSHR
Dimethylamine SCHEMBL918206 0.84 APP (0.41) APPPTGS1PDE4AALDH1A1TSHR
SCHEMBL353885 0.84 ALDH1A1 (0.48) APPPTGS1PDE4AALDH1A1TSHR
SCHEMBL17655619 0.82 ALDH1A1 (0.52) APPPTGS1PDE4AALDH1A1TSHR

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-115003776-A Polymer dispersions for oil field friction reduction 索尔维美国有限公司 2022-09-02 CN disclosed
CN-112888761-A Polymer dispersions obtained by controlled radical polymerization 罗地亚经营管理公司 2021-06-01 CN disclosed