SCHEMBL9327746

SCHEMBL9327746

CCCCCC(C)CO[PH](=O)OCC(C)CCCCC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.41
OPRM1 P35372 1/20 0.38
CA1 P00915 2/20 0.36
TP53 P04637 1/20 0.35
TRPM8 Q7Z2W7 5/20 0.34
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
SMPD1 P17405 3/20 0.33
FDPS P14324 2/20 0.33
GPR84 Q9NQS5 2/20 0.32
ZDHHC7 Q9NXF8 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
SCHEMBL8436443 0.98 ACE2 (0.44) ACE2OPRM1CA1TRPM8ADH1B
SCHEMBL15053547 0.98 ACE2 (0.44) ACE2OPRM1CA1TRPM8ADH1B
SCHEMBL8439665 0.94 TSHR (0.35) ACE2OPRM1CA1TRPM8FDPS
SCHEMBL29768825 0.92 TSHR (0.34) ACE2CA1TRPM8FDPS
SCHEMBL5090016 0.85 TSHR (0.39) CA1
SCHEMBL8433527 0.82 ACE2 (0.46) ACE2CA1TP53SMPD1FDPS
SCHEMBL31330274 0.82 OPRM1 (0.39) ACE2OPRM1CA1TP53ADH1B
SCHEMBL9326349 0.81 LMNA (0.48)
Octane SCHEMBL11647979 0.78 TRPM8 (0.40) TRPM8
SCHEMBL28480886 0.78 GPR84 (0.46) SMPD1FDPSGPR84

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
EP-0395258-B1 Process for preparing sulfurized branched alkyl phosphite lubricant additive ETHYL PETROLEUM ADDITIVES INC (US) 1994-03-09 EP claimed