SCHEMBL441692

SCHEMBL441692

CCCCCC(=O)OCCCCC(O)CO

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.64
DUSP3 P51452 1/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
LMNA P02545 1/20 0.64
DGKA P23743 2/20 0.58
MAPT P10636 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
CNR2 P34972 1/20 0.49
FAAH O00519 2/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PRKCA P17252 1/20 0.49
PRKCE Q02156 1/20 0.49
PRKCQ Q04759 1/20 0.49
PRKCD Q05655 1/20 0.49
DNM1 Q05193 1/20 0.49
FFAR4 Q5NUL3 1/20 0.49

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
Alcohol SCHEMBL2356259 0.90 DGKA (0.62) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL27302948 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL27567967 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL7523298 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL1004684 0.90 KDM4E (0.68) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL7895803 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
Cetyl Palmitate SCHEMBL28216712 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL394035 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
Glycerin SCHEMBL14562870 0.90 KDM4E (0.73) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL3487063 0.90 DGKA (0.67) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160031781-A1 AGENT FOR IMPROVING TISSUE PENETRATION GENZYME CORPORATION (US) 2016-02-04 US disclosed
US-20120064147-A1 AGENT FOR IMPROVING TISSUE PENETRATION GENZYME CORPORATION (US) 2012-03-15 US disclosed
US-20090312440-A1 AGENT FOR IMPROVING TISSUE PENETRATION MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSHAFTEN E.V. (DE) 2009-12-17 US disclosed
US-20040146535-A1 Agent for improving tissue penetration MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSHAFTEN E.V. (DE) 2004-07-29 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 (4 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-20040146535-A1 Agent for improving tissue penetration PGF, MMP8, MMP1 KDM4E 4826/4885DUSP3 3728/4885MEN1 2672/4885
US-20090312440-A1 AGENT FOR IMPROVING TISSUE PENETRATION PGF, MMP8, MMP1 KDM4E 4826/4885DUSP3 3728/4885MEN1 2672/4885
US-20160031781-A1 AGENT FOR IMPROVING TISSUE PENETRATION PGF, MMP8, MMP1 KDM4E 4826/4885DUSP3 3728/4885MEN1 2672/4885
US-20120064147-A1 AGENT FOR IMPROVING TISSUE PENETRATION PGF, MMP8, MMP1 KDM4E 4826/4885DUSP3 3728/4885MEN1 2672/4885

“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.