SCHEMBL4277935

SCHEMBL4277935

CCCCC(CC)C(=O)OC(CO)CO.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.59
CA1 P00915 4/20 0.59
MAPK1 P28482 2/20 0.50
MAPT P10636 2/20 0.47
PRKCA P17252 3/20 0.41
PRKCE Q02156 1/20 0.41
PRKCQ Q04759 1/20 0.41
PRKCD Q05655 1/20 0.41
GAA P10253 1/20 0.40
XBP1 P17861 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.39
FAAH O00519 1/20 0.39
HPGD P15428 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL4286403 0.98 CA2 (0.61) CA2CA1MAPK1MAPTPRKCA
Glycerin SCHEMBL28599472 0.92 CA2 (0.54) CA2CA1MAPK1MAPTPRKCA
Glycerin SCHEMBL28916086 0.92 CA2 (0.54) CA2CA1MAPK1MAPTPRKCA
Glycerin SCHEMBL28587077 0.92 CA2 (0.54) CA2CA1MAPK1MAPTPRKCA
Adipic Acid SCHEMBL8823087 0.89 CA2 (0.51) CA2CA1MAPK1MAPTPRKCA
SCHEMBL1838752 0.88 CA2 (0.54) CA2CA1MAPK1MAPTPRKCA
SCHEMBL1486327 0.85 CA2 (0.51) CA2CA1MAPK1MAPTPRKCA
SCHEMBL29054903 0.84 MAPT (0.58) CA2CA1MAPK1MAPTPRKCA
SCHEMBL29016127 0.84 MAPT (0.58) CA2CA1MAPK1MAPTPRKCA
SCHEMBL31563027 0.84 MAPT (0.58) CA2CA1MAPK1MAPTPRKCA

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-20090257968-A1 Gels containing anionic surfactants and coupling agents WALTON RICHARD 2009-10-15 US claimed
US-20050220832-A1 Gels containing metallic soaps and coupling agents WALTON RICHARD 2005-10-06 US claimed
US-20090257968-A1 Gels containing anionic surfactants and coupling agents WALTON RICHARD 2009-10-15 US disclosed
US-20050220832-A1 Gels containing metallic soaps and coupling agents WALTON RICHARD 2005-10-06 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 (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-20050220832-A1 Gels containing metallic soaps and coupling agents MSN, S100P, STMN1 CA2 275/4885CA1 226/4885MAPK1 2623/4885
US-20090257968-A1 Gels containing anionic surfactants and coupling agents RAB5IF, ANXA4, ANXA11 CA2 1415/4885CA1 1863/4885MAPK1 3835/4885

“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.