SCHEMBL13129209

SCHEMBL13129209

C=CC(=O)OCCO[Si](C)(C)OC

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
ALDH1A1 P00352 4/20 0.53
TP53 P04637 3/20 0.53
HIF1A Q16665 3/20 0.53
HSD17B10 Q99714 1/20 0.53
HPGD P15428 1/20 0.48
CYP3A4 P08684 2/20 0.48
THRB P10828 3/20 0.45
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ATM Q13315 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
SCHEMBL12616790 0.90 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7759302 0.89 TSHR (0.60) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL30450231 0.88 TSHR (0.63) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL30450181 0.88 TSHR (0.63) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL13129200 0.87 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL13129199 0.85 TSHR (0.53) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL14347100 0.85 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL19469311 0.85 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL23466722 0.85 TSHR (0.53) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL476966 0.84 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10

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-20140370250-A1 INKJET INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2014-12-18 US disclosed
US-8344045-B2 Ink composition, inkjet recording method, printed material, and process for producing molded printed material FUJIFILM CORPORATION (JP) 2013-01-01 US disclosed
US-20100239830-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATERIAL, AND PROCESS FOR PRODUCING MOLDED PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2010-09-23 US disclosed
US-20090202795-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATERIAL, AND MOLDED PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed