SCHEMBL30363554

SCHEMBL30363554

C=CC(=O)OCCO.C=CC(=O)OCCO.C=CC(=O)OCCO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 1.00
ALDH1A1 P00352 5/20 0.65
TP53 P04637 3/20 0.65
HIF1A Q16665 3/20 0.65
CYP3A4 P08684 2/20 0.65
HSD17B10 Q99714 1/20 0.65
HPGD P15428 1/20 0.58
MAPK1 P28482 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
THRB P10828 2/20 0.47
ATM Q13315 1/20 0.34
ACHE P22303 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
LMNA P02545 1/20 0.32
MGLL Q99685 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
SCHEMBL14875 1.00
SCHEMBL21630258 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene SCHEMBL2946941 0.97 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2457464 0.97
Ethylene SCHEMBL4213298 0.97 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene SCHEMBL8048018 0.97 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene SCHEMBL8850416 0.97 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Hydrochloric Acid SCHEMBL8657697 0.97
Ethylene Glycol SCHEMBL8650028 0.97 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene SCHEMBL8852464 0.97 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113968937-B Thermosetting biobased casting material, molded body produced therefrom and method for producing such molded body 肖克有限公司 2024-12-27 CN claimed
CN-117986916-A UV-LED cured tin printing ink and preparation method thereof 长兴特殊材料(苏州)有限公司 2024-05-07 CN claimed
WO-2023070186-A1 UV-CURABLE ADDITIVE POWDER COMPOSITION, METHOD FOR PREPARING THE COMPOSITION, METHOD FOR PREPARING A POWDER RESIN, PAINT OR VANISH CURABLE BY UV RADIATION, UV-CURABLE POWDER RESIN, PAINT OR VARNISH AND USE OF THE COMPOSITION WEKOAMÉRICA LATINA EQUIPAMENTOS INDUSTRIAIS LTDA. (BR) 2023-05-04 WO claimed
CN-117986916-A UV-LED cured tin printing ink and preparation method thereof 长兴特殊材料(苏州)有限公司 2024-05-07 CN disclosed
CN-111490230-B Electrode, method for manufacturing the same, electrode element, and nonaqueous electrolyte electricity storage element 株式会社理光 2024-05-07 CN disclosed
CN-116964803-A Electrode assembly, secondary battery, battery module, battery pack, and power consumption device 宁德时代新能源科技股份有限公司 2023-10-27 CN disclosed
WO-2023070186-A1 UV-CURABLE ADDITIVE POWDER COMPOSITION, METHOD FOR PREPARING THE COMPOSITION, METHOD FOR PREPARING A POWDER RESIN, PAINT OR VANISH CURABLE BY UV RADIATION, UV-CURABLE POWDER RESIN, PAINT OR VARNISH AND USE OF THE COMPOSITION WEKOAMÉRICA LATINA EQUIPAMENTOS INDUSTRIAIS LTDA. (BR) 2023-05-04 WO disclosed