SCHEMBL2120609

SCHEMBL2120609

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
ADRA1D P25100 1/20 0.47
PTAFR P25105 1/20 0.47
HTR1D P28221 1/20 0.47
HTR2C P28335 1/20 0.47
ADRA1B P35368 1/20 0.47
DRD3 P35462 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
NR5A2 O00482 1/20 0.46
NR5A1 Q13285 1/20 0.46
PLA2G10 O15496 1/20 0.44
MAPT P10636 1/20 0.44
LMNA P02545 2/20 0.43
AKT1 P31749 2/20 0.43
ESR1 P03372 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CDC25A P30304 1/20 0.43
AGTR1 P30556 1/20 0.43
ADRA1A P35348 1/20 0.43
KCNH2 Q12809 1/20 0.43

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
SCHEMBL2120563 0.86 SMN1; SMN2 (0.52) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL968958 0.85 FABP3 (0.45) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL1225864 0.82 SMN1; SMN2 (0.53) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL139079 0.79 SMN1; SMN2 (0.49) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL28126982 0.78 SMN1; SMN2 (0.34) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL30652867 0.78 ADRA1D (0.77) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL2120223 0.77 LMNA (0.57) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL2117742 0.77 LMNA (0.54) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL28965396 0.77 SMN1; SMN2 (0.73) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C
SCHEMBL2119799 0.76 LMNA (0.60) SMN1; SMN2ADRA1DPTAFRHTR1DHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250188288-A1 ANTI-FOULING POLYMERIC AGENTS EDWARDS MARK IEUAN (GB) 2025-06-12 US disclosed
EP-4490237-A1 ANTI-FOULING POLYMERIC AGENTS Edwards, Mark Ieuan (GB) 2025-01-15 EP disclosed
EP-4438132-A2 STABLE MICROCAPSULE COMPOSITIONS International Flavors & Fragrances Inc. (US) 2024-10-02 EP disclosed
EP-3478249-B1 STABLE MICROCAPSULE COMPOSITIONS INT FLAVORS & FRAGRANCES INC (US) 2024-09-11 EP disclosed
EP-3416610-B1 MICROCAPSULE COMPOSITION INT FLAVORS & FRAGRANCES INC (US) 2024-08-14 EP disclosed
WO-2023170427-A1 ANTI-FOULING POLYMERIC AGENTS EDWARDS MARK IEUAN (GB) 2023-09-14 WO disclosed
EP-4209264-A1 MICROCAPSULE COMPOSITIONS STABILIZED WITH VISCOSITY CONTROL AGENTS International Flavors & Fragrances Inc. (US) 2023-07-12 EP disclosed
EP-3512625-B1 MICROCAPSULE COMPOSITIONS STABILIZED WITH VISCOSITY CONTROL AGENTS INT FLAVORS & FRAGRANCES INC (US) 2023-04-26 EP disclosed
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