SCHEMBL28817064

SCHEMBL28817064

C=CC(=O)OCCOC1(CC)COC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TP53 P04637 3/20 0.46
HIF1A Q16665 3/20 0.46
HSD17B10 Q99714 1/20 0.46
THRB P10828 3/20 0.43
CYP3A4 P08684 2/20 0.42
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ATM Q13315 1/20 0.30

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
SCHEMBL28536429 0.81 TSHR (0.48) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL17222382 0.79 ALDH1A1 (0.35) TSHRALDH1A1
SCHEMBL5028522 0.78 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1357080 0.76 TSHR (0.47) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL7879723 0.76 TSHR (0.51) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL17222387 0.76 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL26703785 0.75 TSHR (0.54) TSHRHPGDALDH1A1TP53HIF1A
Propane SCHEMBL6904776 0.73 TSHR (0.73) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL17222371 0.73 TSHR (0.31) TSHR
SCHEMBL21385223 0.73 TSHR (0.51) TSHRHPGDALDH1A1TP53HIF1A

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
CN-109696800-B Colored photosensitive resin composition, pattern layer, color filter and display device 东友精细化工有限公司 2022-07-22 CN disclosed
CN-107272331-B Curable resin composition and cured film 住友化学株式会社 2021-09-24 CN disclosed