SCHEMBL28616629

SCHEMBL28616629

C=COCCOCCOCCO[C](C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 3/20 0.41
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 2/20 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
SCHEMBL28941738 1.00 ALDH1A1 (0.41) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL2203759 0.93
SCHEMBL3156609 0.83 ALDH1A1 (0.54) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL5196564 0.83 ALDH1A1 (0.54) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL19479919 0.81 ALDH1A1 (0.38) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL1538375 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL7764417 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL20582128 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL143831 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL36823 0.80 ALDH1A1 (0.38) ALDH1A1TSHRTP53HIF1AHSD17B10

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113383044-B Sprayable compositions 伊莱克特拉聚合材料有限公司 2023-01-03 CN disclosed
CN-115477871-A Active energy ray-curable ink composition DIC株式会社 2022-12-16 CN disclosed
CN-113348216-B Radiation curable inkjet inks for interior decoration 爱克发有限公司 2022-08-02 CN disclosed
CN-113383044-A Sprayable composition 伊莱克特拉聚合材料有限公司 2021-09-10 CN disclosed
CN-113348216-A Radiation curable inkjet inks for interior decoration 爱克发有限公司 2021-09-03 CN disclosed
CN-113302244-A Radiation curable inkjet inks for interior decoration 爱克发有限公司 2021-08-24 CN disclosed