SCHEMBL17798482

SCHEMBL17798482

CCCCOC(C)OC(C)OC(C)c1ccc(C(=O)O)c(C(=O)O)c1C(C)OC(C)OC(C)OCCCC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.36
PLA2G4B P0C869 3/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
RARB P10826 4/20 0.33
ALDH1A1 P00352 2/20 0.33
RARA P10276 1/20 0.33
PTPN11 Q06124 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
RXRA P19793 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL3679170 0.98 PLK1 (0.38) PLK1PLA2G4BTP53TSHRRARB
SCHEMBL17797801 0.92 TP53 (0.34) PLK1PLA2G4BTP53TSHRRARB
SCHEMBL3677299 0.89 TP53 (0.35) PLK1PLA2G4BTP53TSHRRARB
SCHEMBL17797822 0.89 ALDH1A1 (0.31) ALDH1A1
SCHEMBL17797877 0.87 TP53 (0.39) PLK1PLA2G4BTP53TSHRRARB
SCHEMBL17797788 0.86 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL8166371 0.86 PLA2G4B (0.39) PLK1PLA2G4BTP53TSHRRARB
SCHEMBL17797923 0.86 ALDH1A1 (0.40) TSHRALDH1A1L3MBTL1
SCHEMBL17797804 0.85 TSHR (0.41) PLK1PLA2G4BTP53TSHRRARB
SCHEMBL17797827 0.83 ALDH1A1 (0.41) TSHRALDH1A1MEN1KMT2AKDM4E

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-20160160005-A1 POLY(VINYL ACETAL) RESIN COMPOSITIONS, LAYERS, AND INTERLAYERS HAVING ENHANCED OPTICAL PROPERTIES SOLUTION INC. (US) 2016-06-09 US claimed
US-9587086-B2 Poly(vinyl acetal) resin compositions, layers, and interlayers having enhanced optical properties EASTMAN CHEMICAL COMPANY (US) 2017-03-07 US disclosed
US-20160159051-A1 POLY(VINYL ACETAL) RESIN COMPOSITIONS, LAYERS, AND INTERLAYERS HAVING ENHANCED OPTICAL PROPERTIES SOLUTIA INC. (US) 2016-06-09 US disclosed
US-20160160005-A1 POLY(VINYL ACETAL) RESIN COMPOSITIONS, LAYERS, AND INTERLAYERS HAVING ENHANCED OPTICAL PROPERTIES SOLUTION INC. (US) 2016-06-09 US disclosed