SCHEMBL16708704

SCHEMBL16708704

CCC(C)C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
ALDH1A1 P00352 3/20 0.38
ABCB11 O95342 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADRA2B P18089 1/20 0.37
OPRD1 P41143 1/20 0.37
SCN5A Q14524 1/20 0.37
KDM4E B2RXH2 1/20 0.35
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
HSD17B10 Q99714 2/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA2 P00918 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
MMP1 P03956 1/20 0.31
MMP2 P08253 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
SCHEMBL20364764 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL2759373 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL20465908 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL12215250 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL20465907 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL18119956 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL879158 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL20364765 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL2759386 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B
SCHEMBL2759387 1.00 TSHR (0.38) TSHRALDH1A1ABCB11CYP3A4ADRA2B

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-20180117888-A1 FLUORINE-CONTAINING COPOLYMER, COMPOSITION, OPTICAL FILM, HARDCOAT FILM, POLARIZING PLATE, AND TOUCH PANEL DISPLAY, AND METHOD FOR PRODUCING FLUORINE-CONTAINING COPOLYMER FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed
US-20150132544-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed