Propene

Propene

SCHEMBL22124207

C=CC.CC(=O)CC(=O)OCCOC(=O)CC(C)=O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.48
GAA P10253 2/20 0.48
SI P14410 2/20 0.48
MGAM2 Q2M2H8 2/20 0.48
TSHR P16473 6/20 0.37
ALDH1A1 P00352 6/20 0.37
TP53 P04637 2/20 0.37
HIF1A Q16665 2/20 0.37
HSD17B10 Q99714 1/20 0.37
DGKA P23743 1/20 0.34
HPGD P15428 1/20 0.33
THRB P10828 3/20 0.32
FAAH O00519 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
CYP3A4 P08684 1/20 0.32
PGR P06401 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
HTR1A P08908 1/20 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
Propene SCHEMBL2704019 1.00 MGAM (0.48) MGAMGAASIMGAM2TSHR
Propene SCHEMBL22124162 1.00 MGAM (0.48) MGAMGAASIMGAM2TSHR
Propene SCHEMBL28035368 0.89 MGAM (0.39) MGAMGAASIMGAM2TSHR
SCHEMBL2701579 0.88 GAA (0.60) MGAMGAASIMGAM2TSHR
Water SCHEMBL2703341 0.85 GAA (0.57) MGAMGAASIMGAM2TSHR
SCHEMBL218670 0.85 TSHR (0.57) MGAMGAASIMGAM2TSHR
SCHEMBL2899347 0.85 MGAM (0.43) MGAMGAASIMGAM2TSHR
SCHEMBL24053912 0.82 MGAM (0.40) MGAMGAASIMGAM2TSHR
SCHEMBL9067370 0.82 MGAM (0.40) MGAMGAASIMGAM2TSHR
SCHEMBL25952323 0.82 GAA (0.48) MGAMGAASIMGAM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220056171-A1 Isocyanate Free Binder ARXADA AG (CH) 2022-02-24 US disclosed
EP-3909702-A1 ISOCYANATE FREE BINDER Lonza Solutions AG (CH) 2021-11-17 EP disclosed
CN-113438992-A Isocyanate-free adhesives 隆萨解决方案股份公司 2021-09-24 CN disclosed
EP-3860780-A1 ISOCYANATE FREE BINDER Lonza Solutions AG (CH) 2021-08-11 EP disclosed
WO-2020127611-A1 ISOCYANATE FREE BINDER LONZA LTD (CH) 2020-06-25 WO disclosed