SCHEMBL6718331

SCHEMBL6718331

CCOC(=O)C(C)(OCC)c1cccc(O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
CYP3A4 P08684 1/20 0.38
PIN1 Q13526 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
POLB P06746 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL5389423 0.88 CNR2 (0.40) CNR2CA12CA1CA2CA7
SCHEMBL5379797 0.88 CNR2 (0.40) CNR2CA12CA1CA2CA7
SCHEMBL3923273 0.83 CNR2 (0.51) CNR2CA12CA1CA2CA7
SCHEMBL7861200 0.83 PIN1 (0.50) KDM4ENPSR1CYP3A4PIN1MAPT
SCHEMBL7646777 0.81 ESR1 (0.47) CNR2KDM4ECA12CA1CA2
SCHEMBL7242921 0.81 ESR1 (0.47) CNR2KDM4ECA12CA1CA2
SCHEMBL9326889 0.81 CNR2 (0.41) CNR2CA12CA1CA2CA7
SCHEMBL17420520 0.79 ACSS2 (0.47) CNR2KDM4ENPSR1CA12CA1
SCHEMBL9326006 0.79 CA12 (0.41) CNR2NPSR1CA12CA1CA2
SCHEMBL17978734 0.77 MEN1 (0.51) NPSR1PIN1MAPTTHRBPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 CNR2 498/4885KDM4E 4633/4885NPSR1 834/4885

“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.