SCHEMBL18543797

SCHEMBL18543797

CCCCCC(CC)C(=O)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.54
MAPK1 P28482 1/20 0.54
CA1 P00915 6/20 0.52
GRIK1 P39086 2/20 0.44
GRIK2 Q13002 2/20 0.44
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 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
SCHEMBL10001196 0.93 CA2 (0.61) CA2MAPK1CA1SLC1A2SLC1A1
SCHEMBL19388762 0.89 CA2 (0.55) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL19245747 0.89 CA2 (0.55) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL25834794 0.89 CA2 (0.55) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL26304628 0.89 CA2 (0.55) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL13246773 0.87 CA2 (0.59) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL24533816 0.83 CA2 (0.53) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL1709348 0.83 CPB2 (0.46) CA2MAPK1CA1
SCHEMBL24506335 0.82 CA2 (0.52) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL17008177 0.82 CA2 (0.48) CA2MAPK1CA1GRIK1GRIK2

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-9682097-B2 Oligonucleotide analogues targeting human LMNA SAREPTA THERAPEUTICS, INC. (US) 2017-06-20 US disclosed
US-20170051278-A1 METHODS FOR TREATING PROGEROID LAMINOPATHIES USING OLIGONUCLEOTIDE ANALOGUES TARGETING HUMAN LMNA SAREPTA THERAPEUTICS, INC. 2017-02-23 US 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-20170051278-A1 METHODS FOR TREATING PROGEROID LAMINOPATHIES USING OLIGONUCLEOTIDE ANALOGUES TARGETING HUMAN LMNA LMNA, LMNB2, LMNB1 CA2 4843/4885MAPK1 4403/4885CA1 4882/4885

“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.