SCHEMBL13347347

SCHEMBL13347347

COCCCCCC(=O)NCCCCNC(=O)CCCCCOC(=O)CCCCC(=O)OCCCCOC(=O)CCCCC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
HPGD P15428 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.41
EPHX2 P34913 8/20 0.41
DGKA P23743 1/20 0.40
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL13347351 0.99 TSHR (0.58) TSHRHPGDMEN1KMT2AL3MBTL1
SCHEMBL13347350 0.96 TSHR (0.54) TSHRHPGDMEN1KMT2AL3MBTL1
SCHEMBL14978085 0.94 TSHR (0.56) TSHRHPGDMEN1KMT2AL3MBTL1
SCHEMBL16250354 0.88 TSHR (0.73) TSHRHPGDMEN1KMT2AL3MBTL1
SCHEMBL17124349 0.86 ALDH1A1 (0.53) TSHRALDH1A1EPHX2DGKA
SCHEMBL799646 0.86 ALDH1A1 (0.53) TSHRALDH1A1EPHX2DGKA
SCHEMBL813053 0.85 ALDH1A1 (0.52) ALDH1A1EPHX2DGKA
SCHEMBL14803668 0.85 ALDH1A1 (0.52) ALDH1A1DGKAMAPT
SCHEMBL17124347 0.84 ALDH1A1 (0.50) TSHRALDH1A1EPHX2DGKA
SCHEMBL14296727 0.84 ALDH1A1 (0.50) TSHRALDH1A1EPHX2DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9150763-B2 Adhesive polymers for forming laminate structures DOW GLOBAL TECHNOLOGIES LLC 2015-10-06 US disclosed
US-20100119832-A1 ADHESIVE POLYMERS FOR FORMING LAMINATE STRUCTURES DOW GLOBAL TECHNOLOGIES LLC 2010-05-13 US disclosed
US-20100064647-A1 POLYMER OR OLIGOMER FIBERS BY SOLVENT-FREE ELECTROSPINNING DOW GLOBAL TECHNOLOGIES LLC 2010-03-18 US disclosed