SCHEMBL13620249

SCHEMBL13620249

CCCCCCC(C)(O)OCC

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.42
FDPS P14324 9/20 0.42
GGPS1 O95749 7/20 0.42
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CES2 O00748 1/20 0.36

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
SCHEMBL27891743 1.00 SMPD1 (0.42) SMPD1FDPSGGPS1MEN1MAPT
SCHEMBL28255184 1.00 SMPD1 (0.42) SMPD1FDPSGGPS1MEN1MAPT
SCHEMBL8641529 0.91 SMPD1 (0.32) SMPD1FDPSGGPS1
SCHEMBL11548756 0.89 FAAH (0.46) MEN1MAPTKMT2AATM
SCHEMBL13620256 0.84 SMPD1 (0.41) SMPD1FDPSGGPS1
SCHEMBL8861613 0.83 SMPD1 (0.40) SMPD1FDPSGGPS1CES2
SCHEMBL6064783 0.81 TSHR (0.40) SMPD1FDPSGGPS1MEN1MAPT
SCHEMBL1563330 0.81 TSHR (0.40) SMPD1FDPSGGPS1MEN1MAPT
Acetic Acid SCHEMBL27586910 0.81 ALDH1A1 (0.34) SMPD1FDPSGGPS1MEN1MAPT
SCHEMBL9426138 0.81 ALDH1A1 (0.46)

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-9925267-B2 Polylactide compositions and uses thereof UNIVERSITY OF GENEVA (CH) 2018-03-27 US disclosed
US-20160367680-A1 POLYLACTIDE COMPOSITIONS AND USES THEREOF UNIVERSITY OF GENEVA (CH) 2016-12-22 US disclosed
US-20090281068-A1 POLYLACTIDE COMPOSITIONS AND USES THEREOF UNIVERSITY OF GENEVA 2009-11-12 US disclosed
CN-100373189-C Liquid crystal film and method for producing elliptically polarizing plate NIPPON OIL CORP (JP) 2008-03-05 CN disclosed
CN-1668946-A Liquid crystal film and method for producing elliptically polarizing plate NIPPON OIL CORP (JP) 2005-09-14 CN disclosed
CN-1199608-A Water-in-oil emulsion, composition comprising such emulsion and use in cosmetics pharmacy or hygiene OREAL (FR) 1998-11-25 CN 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-20090281068-A1 POLYLACTIDE COMPOSITIONS AND USES THEREOF LPXN, PUF60, DDOST SMPD1 526/4885FDPS 373/4885GGPS1 459/4885
US-20160367680-A1 POLYLACTIDE COMPOSITIONS AND USES THEREOF LPXN, PUF60, DDOST SMPD1 526/4885FDPS 373/4885GGPS1 459/4885

“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.