SCHEMBL5580131

SCHEMBL5580131

CCCCCCC(CCCCC)C(=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 2/20 0.58
CA2 P00918 2/20 0.53
ZDHHC7 Q9NXF8 1/20 0.50
CA1 P00915 1/20 0.48
GRIK1 P39086 2/20 0.47
GRIK2 Q13002 2/20 0.47
GPR84 Q9NQS5 7/20 0.47
FFAR1 O14842 1/20 0.47
MAPT P10636 1/20 0.45
LCK P06239 1/20 0.45
PPARD Q03181 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44

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
SCHEMBL63623 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL5516547 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL3454038 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL6899785 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL25341592 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL18531126 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL23879492 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL571313 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL19148651 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1
SCHEMBL29209211 1.00 CPB2 (0.58) CPB2CA2ZDHHC7CA1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170015659-A1 Prodrugs of NH-Acidic Compounds JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2017-01-19 US disclosed
US-8389508-B2 Heterocyclic compounds GLAXO GROUP LIMITED (GB) 2013-03-05 US disclosed
US-20110269738-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-11-03 US disclosed
US-7220783-B2 Para-terphenyl compounds SHIONOGI & CO., LTD. (JP) 2007-05-22 US disclosed
US-7101915-B1 P-terphenyl compounds SHIONOGI & CO., LTD. (JP) 2006-09-05 US disclosed
US-7074836-B1 SUPPRESSION CELL DIFFERENTIATION OF CELL INTO ANTIBODY; SUPPRESS IMMONOGLOBULINS; ANTIALLERGENS SHIONOGI & CO., LTD. (JP) 2006-07-11 US disclosed
US-20040127495-A1 Novel para-terphenyl compounds SHIONOGI & CO., LTD. 2004-07-01 US disclosed
EP-0933346-B1 NOVEL p-TERPHENYL COMPOUNDS SHIONOGI & CO (JP) 2003-12-10 EP disclosed
CN-1232443-A Novel p-terphenyl compounds SHIONOGI & CO (JP) 1999-10-20 CN disclosed
EP-0933346-A1 NOVEL p-TERPHENYL COMPOUNDS SHIONOGI & CO., LTD. (JP) 1999-08-04 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 (3 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-20040127495-A1 Novel para-terphenyl compounds FCGR3B, FCGR2A, FCGRT CPB2 3140/4885CA2 3921/4885ZDHHC7 658/4885
US-20110269738-A1 COMPOUNDS CYP11B2, CYP11B1, GPR119 CPB2 1679/4885CA2 2217/4885ZDHHC7 2061/4885
US-20170015659-A1 Prodrugs of NH-Acidic Compounds SI, NAAA, NIT2 CPB2 1201/4885CA2 205/4885ZDHHC7 1490/4885

“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.