SCHEMBL8640307

SCHEMBL8640307

C=C(CC(=O)O)C(=O)OC(CC(C)C)CC(C)C

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 2/20 0.36
CACNB3 P54284 1/20 0.36
CACNA1C Q13936 1/20 0.36
PGR P06401 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
CACNA2D2 Q9NY47 1/20 0.36
CTSK P43235 1/20 0.36
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FOLH1 Q04609 8/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 2/20 0.32
RNPEP Q9H4A4 1/20 0.32
SLC7A5 Q01650 1/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL28292545 0.91 CACNA2D1 (0.33) CACNA2D1CACNB3CACNA1CPGRADRA1A
SCHEMBL8638705 0.87 CACNA2D1 (0.31) CACNA2D1CACNB3CACNA1CPGRADRA1A
SCHEMBL18825736 0.87 ALOX15 (0.35) CACNA2D1CACNB3CACNA1CPGRADRA1A
SCHEMBL8646623 0.82 TSHR (0.35) CACNA2D1CACNB3CACNA1CPGRADRA1A
SCHEMBL5175528 0.81 ALOX15 (0.36) CTSKALOX15HSD17B10
SCHEMBL8647071 0.81 ALOX15 (0.32) CACNA2D1CACNB3CACNA1CPGRADRA1A
SCHEMBL481426 0.80 ALOX15 (0.39) ADRA1AALOX15HSD17B10TSHRALDH1A1
SCHEMBL481422 0.79 ALOX15 (0.38) ALOX15HSD17B10TSHRALDH1A1MEN1
SCHEMBL9773599 0.78 ALOX15 (0.34) CACNA2D1CACNB3CACNA1CPGRADRA1A
SCHEMBL11033411 0.77 ALOX15 (0.36) ALOX15HSD17B10TSHR

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-5851422-A Polymeric material for liquid crystal/polymer composite film, record display medium, and use thereof DAI NIPPON PRINTING CO., LTD. (JP) 1998-12-22 US disclosed
EP-0790289-A1 Polymeric material for liquid crystal/polymer composite film, liquid crystal/polymer composite film, record display medium, and use thereof DAI NIPPON PRINTING CO., LTD. (JP) 1997-08-20 EP disclosed