SCHEMBL14906341

SCHEMBL14906341

CCCCCCCCCCC(O)CN(CC(O)CCCCCCCCCC)C(CC(C)C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.47
GRIK1 P39086 2/20 0.46
GRIK2 Q13002 2/20 0.46
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
FAAH O00519 2/20 0.44
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
ACE2 Q9BYF1 1/20 0.42
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41

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
SCHEMBL15044748 0.88 GPR84 (0.44) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL26624055 0.86 GPR84 (0.51) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL14906343 0.84 GPR84 (0.54) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL14906293 0.83 GPR84 (0.62) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL14906306 0.83 GPR84 (0.49) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL14906281 0.82 FFAR1 (0.58) GPR84FFAR1FFAR4FAAHPPARD
SCHEMBL14906280 0.81 GPR84 (0.53) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL29978498 0.81 GPR84 (0.46) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL29978283 0.81 GPR84 (0.46) GPR84GRIK1GRIK2FFAR1FFAR4
SCHEMBL15044874 0.81 FFAR1 (0.49) GPR84GRIK1GRIK2FFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170165290-A1 AMINO ACID-, PEPTIDE- AND POLYPEPTIDE-LIPIDS, ISOMERS, COMPOSITIONS, AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-06-15 US disclosed
US-9512073-B2 Amino acid-, peptide-and polypeptide-lipids, isomers, compositions, and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-12-06 US disclosed
US-20130158021-A1 AMINO ACID-, PEPTIDE-AND POLYPEPTIDE-LIPIDS, ISOMERS, COMPOSITIONS, AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-06-20 US disclosed
WO-2013063468-A1 AMINO ACID DERIVATES FUNCTIONALIZED ON THE N- TERMINAL CAPABLE OF FORMING DRUG INCAPSULATING MICROSPHERES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-05-02 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 (2 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-20170165290-A1 AMINO ACID-, PEPTIDE- AND POLYPEPTIDE-LIPIDS, ISOMERS, COMPOSITIONS, AND USES THEREOF APLNR, NPPA, ARGLU1 GPR84 225/4885GRIK1 2689/4885GRIK2 2626/4885
US-20130158021-A1 AMINO ACID-, PEPTIDE-AND POLYPEPTIDE-LIPIDS, ISOMERS, COMPOSITIONS, AND USES THEREOF APLNR, NPPA, ARGLU1 GPR84 225/4885GRIK1 2689/4885GRIK2 2626/4885

“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.