SCHEMBL8400655

SCHEMBL8400655

CCOC(OCC)(OCCO)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.38
ALDH1A1 P00352 1/20 0.36
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
FDPS P14324 2/20 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
SCHEMBL8722288 0.74 PPARD (0.35) PPARDALDH1A1CYP4F2CYP4A11FDPS
SCHEMBL8878747 0.71 FDPS (0.31) FDPS
SCHEMBL8713190 0.71 FDPS (0.31) FDPS
SCHEMBL8962507 0.67 FDPS (0.35) FDPS
SCHEMBL8662380 0.66 LPAR1 (0.31)
SCHEMBL18486439 0.66 LMNA (0.39) PPARDFDPS
SCHEMBL13186023 0.66 LMNA (0.39) PPARDALDH1A1FDPS
SCHEMBL13536980 0.66 ALDH1A1 (0.50) ALDH1A1CYP4F2CYP4A11
Phosphoric Acid SCHEMBL10321610 0.64 LPAR3 (0.34) PPARDCYP4F2CYP4A11FDPS
SCHEMBL3139430 0.64 ALDH1A1 (0.42) ALDH1A1CYP4F2CYP4A11

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-5874577-A Method for the preparing 9-12-(Diethoxyphosphonomethoxy)ethyl!adenine and analogues thereof MEDICHEM RESEARCH, INC. (US) 1999-02-23 US disclosed