SCHEMBL2360465

SCHEMBL2360465

CC(CC(=O)Cl)C(=O)Cl.CC(CC(=O)Cl)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.39
CYP1A2 P05177 1/20 0.39
FOLH1 Q04609 2/20 0.34
NAALAD2 Q9Y3Q0 2/20 0.34
ENPEP Q07075 2/20 0.34
BLM P54132 1/20 0.34
TP53 P04637 1/20 0.33
STING1 Q86WV6 1/20 0.33

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
SCHEMBL3153473 0.93
SCHEMBL652869 0.90
SCHEMBL22339943 0.90
Succinic Acid SCHEMBL28878150 0.84 CYP1A2 (0.43) CYP1A2FOLH1
SCHEMBL2388469 0.77
SCHEMBL2387753 0.77
Tetrahydrofuran SCHEMBL28137719 0.74 ALDH1A1 (0.34)
SCHEMBL10412398 0.74 ALDH1A1 (0.35) TP53
SCHEMBL9416705 0.73
SCHEMBL3053013 0.73 GABRR1 (0.41) GABRR1CYP1A2FOLH1NAALAD2ENPEP

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
US-20110196170-A1 METHOD FOR PRODUCING ASTAXANTHIN DIMETHYLDISUCCINATE BASF SE (DE) 2011-08-11 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-20110196170-A1 METHOD FOR PRODUCING ASTAXANTHIN DIMETHYLDISUCCINATE ALAD, FDFT1, AMD1 GABRR1 4111/4885CYP1A2 794/4885FOLH1 1822/4885

“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.