SCHEMBL19934818

SCHEMBL19934818

C=CC(=O)OCCCCOC(=O)CCCCCCCC(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.66
ALDH1A1 P00352 4/20 0.66
CYP3A4 P08684 1/20 0.66
HPGD P15428 1/20 0.50
TP53 P04637 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 1/20 0.46
ABCC4 O15439 1/20 0.44
MAPT P10636 1/20 0.44
DGKA P23743 1/20 0.43
THRB P10828 1/20 0.42
LMNA P02545 2/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
NPC1 O15118 1/20 0.41
PAM P19021 2/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
EPHX2 P34913 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
SCHEMBL19934811 1.00 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL10033426 1.00 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL17280885 1.00 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL15828343 1.00 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL29810451 0.98 TSHR (0.62) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL12251535 0.97 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL5945216 0.97 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL18828895 0.95 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL18828976 0.95 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL449384 0.95 TSHR (0.62) TSHRALDH1A1CYP3A4HPGDTP53

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-11795399-B2 UV curable adhesion promoters based on functionalised polyvinyl alcohols MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
US-11795399-B2 UV curable adhesion promoters based on functionalised polyvinyl alcohols MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
EP-3507343-B1 UV CURABLE ADHESION PROMOTERS BASED ON FUNCTIONALISED POLYVINYL ALCOHOLS MERCK PATENT GMBH (DE) 2020-10-21 EP disclosed
WO-2018042026-A1 UV CURABLE ADHESION PROMOTERS BASED ON FUNCTIONALISED POLYVINYL ALCOHOLS MERCK PATENT GMBH (DE) 2018-03-08 WO disclosed