SCHEMBL11247302

SCHEMBL11247302

O=S(=O)(O)CCCNC(CO)CO

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
LMNA P02545 3/20 0.39
CNR1 P21554 2/20 0.39
ADRA1A P35348 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ABCC3 O15438 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33
EPHX2 P34913 1/20 0.32

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
SCHEMBL11144257 0.88 LMNA (0.41) APPLMNACNR1ADRA1ATDP1
SCHEMBL918465 0.88 LMNA (0.59) APPLMNACNR1ADRA1ATDP1
SCHEMBL3605997 0.88 LMNA (0.59) APPLMNACNR1ADRA1ATDP1
SCHEMBL918440 0.88 LMNA (0.59) APPLMNACNR1ADRA1ATDP1
SCHEMBL11234459 0.88 CNR1 (0.36) APPLMNACNR1ADRA1ATDP1
SCHEMBL355121 0.86 LMNA (0.38) APPLMNACNR1ADRA1ATDP1
SCHEMBL14641265 0.86 LMNA (0.38) APPLMNACNR1ADRA1ATDP1
SCHEMBL11242154 0.86 CNR1 (0.38) APPLMNACNR1ADRA1ATDP1
SCHEMBL356132 0.86 LMNA (0.38) APPLMNACNR1ADRA1ATDP1
SCHEMBL353710 0.85 LMNA (0.41) APPLMNACNR1ADRA1ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4322324-A Ampho-ionic group-containing alkyd resins NIPPON PAINT CO., LTD. (JP) 1982-03-30 US disclosed