Propene

Propene

SCHEMBL9204087

C=CC.CC(C)COC=O

nearest known ligand 0.41

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.33
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33

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
SCHEMBL25812 0.89
SCHEMBL20485768 0.89 ALDH1A1 (0.39) TSHRALDH1A1ADH1BADH1CADH1A
Ammonia Solution, Strong SCHEMBL28283558 0.87
SCHEMBL28213189 0.87
Hydrochloric Acid SCHEMBL5363750 0.87
SCHEMBL27257823 0.87
Formic Acid Methyl Ester SCHEMBL8823843 0.82 ALDH1A1 (0.35) TSHRALDH1A1ADH1BADH1CADH1A
Benzene SCHEMBL28199633 0.82 ALDH1A1 (0.35) TSHRALDH1A1ADH1BADH1CADH1A
Propene SCHEMBL28053091 0.81 MAPK1 (0.34) TSHR
Isobutanol SCHEMBL8651752 0.80 TSHR (0.45) TSHRALDH1A1ADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0469786-B1 High surface area magnesia as hardener for phenolic resins BORDEN INC (US) 1995-01-25 EP disclosed