SCHEMBL820759

SCHEMBL820759

CCCC[C@@]1(C(=O)O)OC(=O)[C@@H](O)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.31
POLB P06746 1/20 0.31
FASN P49327 1/20 0.31
PTPN1 P18031 3/20 0.31
ACP1 P24666 2/20 0.31
CDC25B P30305 2/20 0.31

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
SCHEMBL606501 0.74 AKR1B1 (0.33) PTPN1
SCHEMBL606692 0.74 AKR1B1 (0.33) PTPN1
SCHEMBL606502 0.74 AKR1B1 (0.33) PTPN1
SCHEMBL11160573 0.68 GPR84 (0.39) PTPN1
SCHEMBL28490120 0.67
SCHEMBL603685 0.64 POLB (0.38) POLBFASNPTPN1
SCHEMBL6156154 0.61
SCHEMBL6156821 0.61
SCHEMBL606836 0.61 POLB (0.38) POLBFASNPTPN1
SCHEMBL2320721 0.61 POLB (0.38) POLBFASNPTPN1

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-20110275838-A1 METHOD FOR OBTAINING CINATRINS C3 AND C1 CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2011-11-10 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-20110275838-A1 METHOD FOR OBTAINING CINATRINS C3 AND C1 C3AR1, CPA3, CYP21A2 SIRT2 1902/4885POLB 3519/4885FASN 621/4885

“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.