SCHEMBL3321601

SCHEMBL3321601

CCCCCCCC(C)OP(O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
FAAH O00519 5/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
SPHK1 Q9NYA1 1/20 0.42
DNM1 Q05193 2/20 0.41
OPRM1 P35372 1/20 0.39
SMPD1 P17405 3/20 0.38
ACE2 Q9BYF1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GPR84 Q9NQS5 2/20 0.38
FDPS P14324 1/20 0.38

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
SCHEMBL5083165 1.00 LMNA (0.46) LMNAFAAHCNR1CNR2SPHK1
SCHEMBL16712169 1.00 LMNA (0.46) LMNAFAAHCNR1CNR2SPHK1
SCHEMBL28778969 1.00 LMNA (0.46) LMNAFAAHCNR1CNR2SPHK1
SCHEMBL30692694 0.91 ALDH1A1 (0.39) LMNAFAAHCNR1CNR2DNM1
SCHEMBL27627092 0.91 ALDH1A1 (0.39) LMNAFAAHCNR1CNR2DNM1
SCHEMBL2767818 0.87 LMNA (0.46) LMNAFAAHCNR1CNR2SPHK1
SCHEMBL28770782 0.82 LMNA (0.44) LMNAFAAHCNR1CNR2SPHK1
SCHEMBL29100357 0.82 LMNA (0.44) LMNAFAAHCNR1CNR2SPHK1
SCHEMBL28984207 0.81
SCHEMBL31174518 0.80 LMNA (0.43) LMNASPHK1DNM1SMPD1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309736-B2 Alkyl H-phosphonates of N,N′-dialkylimidazoliums and of quaternary ammoniums and uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2012-11-13 US disclosed
US-20100121075-A1 ALKYL H-PHOSPHONATES OF N,N'-DIALKYLIMIDAZOLIUMS AND OF QUATERNARY AMMONIUMS AND USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS- (FR) 2010-05-13 US disclosed
EP-2118071-A2 ALKYL H-PHOSPHONATES OF N,N'-DIALKYLIMIDAZOLIUMS AND OF QUATERNARY AMMONIUMS, AND USES THEREOF Centre National de la Recherche Scientifique (CNRS) (FR) 2009-11-18 EP disclosed
WO-2008101881-A2 ALKYL H-PHOSPHONATES OF N,N'-DIALKYLIMIDAZOLIUMS AND OF QUATERNARY AMMONIUMS, AND USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2008-08-28 WO disclosed
EP-0772647-B2 POLYACRYLATE RESIN SOLUTIONS WITH IMPROVED COLOUR INDEX AND THEIR USE IN COATINGS BASF COATINGS AG (DE) 2007-04-25 EP disclosed
EP-0772647-B1 POLYACRYLATE RESIN SOLUTIONS WITH IMPROVED COLOUR INDEX AND THEIR USE IN COATINGS BASF COATINGS AG (DE) 2003-12-03 EP disclosed
EP-0772647-A1 POLYACRYLATE RESIN SOLUTIONS WITH IMPROVED COLOUR INDEX AND THEIR USE BASF Lacke und Farben AG (DE) 1997-05-14 EP disclosed
WO-1996003458-A1 POLYACRYLATE RESIN SOLUTIONS WITH IMPROVED COLOUR INDEX AND THEIR USE BASF LACKE + FARBEN AG (DE) 1996-02-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100121075-A1 ALKYL H-PHOSPHONATES OF N,N'-DIALKYLIMIDAZOLIUMS AND OF QUATERNARY AMMONIUMS AND USES THEREOF INPPL1, PHOSPHO1, PHPT1 LMNA 3790/4885FAAH 4217/4885CNR1 4433/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.