SCHEMBL667487

SCHEMBL667487

CCCCC(CCCC)C(O)(P)CCCC

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.42
ALDH1A1 P00352 1/20 0.33
DNM1 Q05193 2/20 0.32
CA2 P00918 2/20 0.31
MAPK1 P28482 1/20 0.31
GGPS1 O95749 2/20 0.30
CA1 P00915 1/20 0.30

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
Hydrochloric Acid SCHEMBL667722 0.98 FDPS (0.41) FDPSALDH1A1DNM1CA2MAPK1
Bromide SCHEMBL21591029 0.98 FDPS (0.41) FDPSALDH1A1DNM1CA2MAPK1
SCHEMBL14840360 0.80 CA1 (0.33) FDPSALDH1A1DNM1CA2MAPK1
SCHEMBL2834536 0.76 FDPS (0.36) FDPSALDH1A1DNM1
SCHEMBL27948038 0.76 FDPS (0.36) FDPSALDH1A1DNM1
SCHEMBL4486788 0.76 FDPS (0.45) FDPSALDH1A1DNM1CA2MAPK1
SCHEMBL8346670 0.76 FDPS (0.45) FDPSALDH1A1DNM1CA2MAPK1
Bromide SCHEMBL3043996 0.74 FDPS (0.35) FDPSALDH1A1DNM1
Iodide SCHEMBL5086927 0.74 FDPS (0.35) FDPSALDH1A1DNM1
Hydrochloric Acid SCHEMBL1977248 0.74 FDPS (0.35) FDPSALDH1A1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9278134-B2 Dual functioning ionic liquids and salts thereof THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2016-03-08 US disclosed
US-20130203602-A1 SUPPORTED BIOLOGICALLY ACTIVE COMPOUNDS DANMARKS TEKNISKE UNIVERSITET (DK) 2013-08-08 US disclosed
EP-2544664-A1 SUPPORTED BIOLOGICALLY ACTIVE COMPOUNDS Danmarks Tekniske Universitet (DK) 2013-01-16 EP disclosed
US-20120046244-A1 DUAL FUNCTIONING IONIC LIQUIDS AND SALTS THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2012-02-23 US disclosed
WO-2011110662-A1 SUPPORTED BIOLOGICALLY ACTIVE COMPOUNDS DANMARKS TEKNISKE UNIVERSITET (DK) 2011-09-15 WO disclosed
WO-2010078300-A1 DUAL FUNCTIONING IONIC LIQUIDS AND SALTS THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2010-07-08 WO 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-20130203602-A1 SUPPORTED BIOLOGICALLY ACTIVE COMPOUNDS MIF, BMP2, BMP4 FDPS 1022/4885ALDH1A1 2373/4885DNM1 4827/4885
US-20120046244-A1 DUAL FUNCTIONING IONIC LIQUIDS AND SALTS THEREOF SLC6A6, SLC10A2, CLK2 FDPS 3430/4885ALDH1A1 3146/4885DNM1 4027/4885

“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.