SCHEMBL9209455

SCHEMBL9209455

C=CC(=O)OC(C)CC(C)(C)CC(C)(C)CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 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
SCHEMBL23494085 0.84 TSHR (0.40) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL23494088 0.82 TSHR (0.44) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL3764447 0.81 TSHR (0.38) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL4655027 0.80 TSHR (0.42) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL8619029 0.79 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL10611134 0.79 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL3764879 0.79 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL28406611 0.78 TSHR (0.44) TSHRALDH1A1TP53CYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL28574510 0.78 TSHR (0.42) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL6273133 0.77 TSHR (0.40) TSHRALDH1A1TP53CYP3A4MAPK1

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
EP-0377633-B1 PEROXIDE FREE RADICAL INITIATORS CONTAINING HINDERED AMINE LIGHT STABILIZER GROUPS ATOCHEM NORTH AMERICA (US) 1995-05-17 EP disclosed
EP-0377633-A4 PEROXIDE FREE RADICAL INITIATORS CONTAINING HINDERED AMINE LIGHT STABILIZER GROUPS 1991-01-30 EP disclosed
EP-0377633-A1 PEROXIDE FREE RADICAL INITIATORS CONTAINING HINDERED AMINE LIGHT STABILIZER GROUPS. PENNWALT CORP (US) 1990-07-18 EP disclosed
US-4925903-A PEROXIDE CONTAINING HINDERED AMINE ALSO FUNCTIONS AS INITIATOR PENNWALT CORPORATION (US) 1990-05-15 US disclosed
US-4885347-A UNSATURATED POLYESTER PENNWALT CORPORATION (US) 1989-12-05 US disclosed
US-4822883-A 2,2,6,6-TETRA SUBSTITUTED PIPERIDIN-4-YL PEROXY DERIVATIVES BECOMING CHEMICALLY BONDED TO ADDITION POLYMER PENNWALT CORPORATION (US) 1989-04-18 US disclosed
WO-1989001474-A1 PEROXIDE FREE RADICAL INITIATORS CONTAINING HINDERED AMINE LIGHT STABILIZER GROUPS PENNWALT CORPORATION (US) 1989-02-23 WO disclosed