SCHEMBL4960877

SCHEMBL4960877

C1COO1.CCCS(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
PTGS1 P23219 1/20 0.38
PDE4A P27815 1/20 0.38
SLC6A6 P31641 1/20 0.38
CYP2C19 P33261 1/20 0.38
BLM P54132 1/20 0.38
APP P05067 1/20 0.35
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.32
EPHX2 P34913 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
Oxirane SCHEMBL28878364 0.90 LMNA (0.38) LMNAPTGS1PDE4ASLC6A6CYP2C19
Fluoride SCHEMBL27350071 0.89
Fluoride SCHEMBL28049667 0.86
SCHEMBL28849565 0.86 LMNA (0.47) LMNAPTGS1PDE4ASLC6A6CYP2C19
SCHEMBL5268 0.86
Cyclohexane SCHEMBL6740252 0.83 PTGS1 (0.41) LMNAPTGS1PDE4ASLC6A6CYP2C19
Ethane SCHEMBL25228294 0.83
SCHEMBL22581628 0.83
SCHEMBL1857134 0.83
SCHEMBL20533802 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893658-A1 N-VINYL CYCLIC LACTAM POLYMER, PRODUCTION METHOD THEREOF, AND APPLICATION THEREOF Nippon Shokubai Co.,Ltd. (JP) 2008-03-05 EP disclosed
WO-2006132385-A1 WATER-SOLUBLE POLYMER, PRODUCTION METHOD THEREOF, AND APPLICATION THEREOF NIPPON SHOKUBAI CO., LTD. (JP) 2006-12-14 WO disclosed
WO-2006126744-A1 N-VINYL CYCLIC LACTAM POLYMER, PRODUCTION METHOD THEREOF, AND APPLICATION THEREOF NIPPON SHOKUBAI CO., LTD. (JP) 2006-11-30 WO disclosed
WO-2006107060-A1 WATER SOLUBLE POLYMER COMPOSITION NIPPON SHOKUBAI CO., LTD. (JP) 2006-10-12 WO disclosed