SCHEMBL10158723

SCHEMBL10158723

COCC(O)COC(=O)OCCCCCC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 1/20 0.37
DUSP3 P51452 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
LPAR1 Q92633 5/20 0.36
LPAR6 P43657 1/20 0.36
LPAR4 Q99677 1/20 0.36
LPAR5 Q9H1C0 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
ENPP2 Q13822 1/20 0.36
PAOX Q6QHF9 1/20 0.36
PLA2G2A P14555 2/20 0.33
DGKA P23743 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL10158672 0.83 ENPP2 (0.40) ALDH1A1LPAR1LPAR6LPAR4LPAR5
SCHEMBL29012508 0.80 ALDH1A1 (0.38) ALDH1A1KDM4EDUSP3MEN1KMT2A
SCHEMBL17230443 0.78 FFAR4 (0.43) ALDH1A1MEN1KMT2APAOXMAPT
SCHEMBL5145826 0.78 FFAR4 (0.43) ALDH1A1MEN1KMT2APAOXMAPT
SCHEMBL10158711 0.78 LMNA (0.32) ALDH1A1KDM4ELMNAMAPT
SCHEMBL10158740 0.76 ALDH1A1 (0.48) ALDH1A1LMNALPAR1LPAR6LPAR4
SCHEMBL10158744 0.75 ALDH1A1 (0.47) ALDH1A1LMNALPAR1LPAR6LPAR4
SCHEMBL12564600 0.75 ALDH1A1 (0.61) ALDH1A1LMNALPAR1LPAR6LPAR4
SCHEMBL17830120 0.75 ALDH1A1 (0.43) ALDH1A1LMNALPAR1LPAR6LPAR4
SCHEMBL10158751 0.75 ALDH1A1 (0.57) ALDH1A1LMNALPAR1LPAR6LPAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160169864-A1 FIBER COATED NANOPORES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-16 US disclosed
US-20130195954-A1 FILMS AND PARTICLES THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2013-08-01 US disclosed
US-8338492-B2 Films and particles THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2012-12-25 US disclosed
US-8334324-B2 Films and particles THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2012-12-18 US disclosed
US-20120107365-A1 FILMS AND PARTICLES THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2012-05-03 US disclosed
US-20110152305-A1 FILMS AND PARTICLES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2011-06-23 US disclosed
US-7671095-B2 Films and particles THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2010-03-02 US disclosed
US-20080075718-A1 Films and Particles THE TRUSTEES OF THE BOSTON UNIVERSITY 2008-03-27 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-20110152305-A1 FILMS AND PARTICLES APOB, PGF, ACTB ALDH1A1 2505/4885KDM4E 4282/4885DUSP3 3363/4885
US-20130195954-A1 FILMS AND PARTICLES APOB, PGF, ACTB ALDH1A1 2505/4885KDM4E 4282/4885DUSP3 3363/4885
US-20080075718-A1 Films and Particles APOB, PGF, ACTB ALDH1A1 2505/4885KDM4E 4282/4885DUSP3 3363/4885
US-20120107365-A1 FILMS AND PARTICLES APOB, PGF, ACTB ALDH1A1 2505/4885KDM4E 4282/4885DUSP3 3363/4885

“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.