SCHEMBL11236699

SCHEMBL11236699

C=C(C)C(=O)OC.C=C(C)C(=O)OC.C=COC(=O)C(C)=CC

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
TSHR P16473 1/20 0.34

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
SCHEMBL17005934 0.88 ALDH1A1 (0.68) ALDH1A1TSHR
SCHEMBL19745993 0.85
SCHEMBL433143 0.85
SCHEMBL433144 0.85
SCHEMBL1245975 0.82 ALDH1A1 (0.65) ALDH1A1TSHR
Propene SCHEMBL27204800 0.81 ALDH1A1 (0.79) ALDH1A1TSHR
Ethylene SCHEMBL18662214 0.80 ALDH1A1 (0.62) ALDH1A1TSHR
SCHEMBL35971 0.79
SCHEMBL7139368 0.78 ALDH1A1 (0.60) ALDH1A1TSHR
SCHEMBL27972757 0.78

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
US-4323600-A THERMOSETTING VINYL COPOLYMER UNDERCOATING CONTAINING PIGMENT BAKED WITH A CLEAR OVERCOATING MITSUI TOATSU CHEMICALS, INC. (JP) 1982-04-06 US disclosed