SCHEMBL17333228

SCHEMBL17333228

[O]P(=O)(OCCCCCCCl)OCCCCCCCl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
LPAR3 Q9UBY5 7/20 0.37
LPAR2 Q9HBW0 6/20 0.37
LPAR1 Q92633 4/20 0.37
LMNA P02545 1/20 0.33
ESR1 P03372 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
CDC25A P30304 1/20 0.33
AGTR1 P30556 1/20 0.33
AKT1 P31749 1/20 0.33
ADRA1A P35348 1/20 0.33
KCNH2 Q12809 1/20 0.33
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL17333473 1.00 ALDH1A1 (0.40) ALDH1A1LPAR3LPAR2LPAR1LMNA
SCHEMBL17333411 0.90 ALDH1A1 (0.43) ALDH1A1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL10534632 0.82 ALDH1A1 (0.62) ALDH1A1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL10536257 0.79 ALDH1A1 (0.65) ALDH1A1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL17333232 0.78 ALDH1A1 (0.63) ALDH1A1
SCHEMBL4527522 0.78 LPAR3 (0.61) ALDH1A1LPAR3LPAR2LPAR1
SCHEMBL4669701 0.78 LPAR3 (0.61) ALDH1A1LPAR3LPAR2LPAR1
SCHEMBL4539277 0.78 LPAR3 (0.61) ALDH1A1LPAR3LPAR2LPAR1
SCHEMBL15264344 0.78 LPAR3 (0.45) ALDH1A1LPAR3LPAR2LPAR1
SCHEMBL4522673 0.78 LPAR3 (0.61) ALDH1A1LPAR3LPAR2LPAR1

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
US-10439252-B2 Electrolyte solution for electrochemical device, and electrochemical device FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-08 US disclosed
US-20150364792-A1 ELECTROLYTE SOLUTION FOR ELECTROCHEMICAL DEVICE, AND ELECTROCHEMICAL DEVICE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-17 US disclosed