SCHEMBL3504085

SCHEMBL3504085

COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.82
LMNA P02545 3/20 0.67
ALDH1A1 P00352 1/20 0.67
RECQL P46063 1/20 0.54
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
EPHX2 P34913 2/20 0.48
POLB P06746 1/20 0.48
POLA1 P09884 1/20 0.48
CA12 O43570 1/20 0.48
CA14 Q9ULX7 1/20 0.48
DGKA P23743 1/20 0.48
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MGAM O43451 1/20 0.48
GAA P10253 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
HPGD P15428 1/20 0.47

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
SCHEMBL494112 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL494299 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL81128 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL3503548 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL3503395 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL3502791 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL118000 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL1286873 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL494114 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL3504568 1.00 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150191607-A1 Anti-fouling Paints and Coatings REACTIVE SURFACES, LTD (US) 2015-07-09 US disclosed
US-20100210745-A1 Molecular Healing of Polymeric Materials, Coatings, Plastics, Elastomers, Composites, Laminates, Adhesives, and Sealants by Active Enzymes REACTIVE SURFACES, LTD. (US) 2010-08-19 US disclosed