SCHEMBL2117747

SCHEMBL2117747

C=CC(=O)OCCCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
AKT1 P31749 2/20 0.60
ESR1 P03372 1/20 0.60
ADORA3 P0DMS8 1/20 0.60
CDC25A P30304 1/20 0.60
AGTR1 P30556 1/20 0.60
ADRA1A P35348 1/20 0.60
KCNH2 Q12809 1/20 0.60
ALDH1A1 P00352 2/20 0.53
TSHR P16473 2/20 0.53
CYP3A4 P08684 1/20 0.53
ADRA1D P25100 1/20 0.46
PTAFR P25105 1/20 0.46
HTR1D P28221 1/20 0.46
HTR2C P28335 1/20 0.46
ADRA1B P35368 1/20 0.46
DRD3 P35462 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
PRKD3 O94806 1/20 0.45

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
SCHEMBL3627911 1.00 LMNA (0.60) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL2119799 1.00 LMNA (0.60) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL2120325 1.00 LMNA (0.60) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL2120824 1.00 LMNA (0.60) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL2118513 1.00 LMNA (0.60) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL2120223 0.99 LMNA (0.57) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL2117742 0.96 LMNA (0.54) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL15389959 0.94 TSHR (0.53) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL15390256 0.94 TSHR (0.53) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL15390493 0.94 TSHR (0.53) LMNAAKT1ESR1ADORA3CDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318824-B2 Hydrophilic polyolefin sintered body ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-11-27 US disclosed
US-20120095121-A1 HYDROPHILIC POLYOLEFIN SINTERED BODY ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-04-19 US disclosed
EP-2174975-A1 HYDROPHILIC POLYOLEFIN SINTERED BODY Asahi Kasei Chemicals Corporation (JP) 2010-04-14 EP disclosed