SCHEMBL607209

SCHEMBL607209

CCCCCCCCCCCCCCCCCCOC(=O)C(C)=CCC1CO1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
NAAA Q02083 3/20 0.40
HCAR2 Q8TDS4 1/20 0.39
RAD52 P43351 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
EPHX1 P07099 1/20 0.38
FAAH O00519 1/20 0.38

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
SCHEMBL9441621 1.00 TSHR (0.47) TSHRALDH1A1TDP1NAAAHCAR2
SCHEMBL1685756 0.94 ALDH1A1 (0.42) TSHRALDH1A1TDP1HCAR2
SCHEMBL7213623 0.88 ALDH1A1 (0.40) TSHRALDH1A1TDP1HCAR2
SCHEMBL2119581 0.87 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL4370786 0.86 ALDH1A1 (0.43) ALDH1A1
SCHEMBL5031593 0.86 ALDH1A1 (0.43) ALDH1A1
SCHEMBL9129129 0.85 ALDH1A1 (0.38) ALDH1A1
SCHEMBL9453050 0.82 ALDH1A1 (0.40) TSHRALDH1A1
SCHEMBL1809474 0.82 ALDH1A1 (0.42) ALDH1A1NPSR1
SCHEMBL8534061 0.80 ALDH1A1 (0.51) TSHRALDH1A1TDP1HCAR2

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-8372926-B2 Fatty acid monomers to reduce emissions and toughen polymers DREXEL UNIVERSITY (US) 2013-02-12 US disclosed
US-8211967-B2 Composite repair resins containing minimal hazardous air pollutants and volatile organic compound DREXEL UNIVERSITY (US) 2012-07-03 US disclosed
US-20120041124-A1 COMPOSITE REPAIR RESINS CONTAINING MINIMAL HAZARDOUS AIR POLLUTANTS AND VOLATILE ORGANIC COMPOUND DREXEL UNIVERSITY (US) 2012-02-16 US disclosed
US-8048949-B1 Composite repair resins containing minimal hazardous air pollutants and volatile organic compound DREXEL UNIVERSITY (US) 2011-11-01 US disclosed
US-20110257320-A1 COMPOSITE REPAIR RESINS CONTAINING MINIMAL HAZARDOUS AIR POLLUTANTS AND VOLATILE ORGANIC COMPOUND DREXEL UNIVERSITY (US) 2011-10-20 US disclosed
US-7524909-B2 Fatty acid monomers to reduce emissions and toughen polymers DREXEL UNIVERSITY (US) 2009-04-28 US disclosed
US-20090018287-A1 Fatty Acid Monomers To Reduce Emissions and Toughen Polymers DREXEL UNIVERSITY (US) 2009-01-15 US disclosed
US-20050250923-A1 Fatty acid monomers to reduce emissions and toughen polymers THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2005-11-10 US disclosed