SCHEMBL9704410

SCHEMBL9704410

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

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
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
SCHEMBL372920 0.76 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL11330857 0.73 ALDH1A1 (0.43) ALDH1A1TSHR
Methacrylic Acid SCHEMBL9704414 0.72 ALDH1A1 (0.30) ALDH1A1
SCHEMBL1898448 0.70 ALDH1A1 (0.42) ALDH1A1TSHR
SCHEMBL3081441 0.70 TSHR (0.43) ALDH1A1TSHR
SCHEMBL27383897 0.70 TSHR (0.32) TSHR
SCHEMBL4601055 0.69 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL1200994 0.69 TSHR (0.48) ALDH1A1TSHR
SCHEMBL4427058 0.69 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL15488096 0.68 ALDH1A1 (0.50) ALDH1A1TSHR

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-0222059-B1 IMPROVED RADIATION-HARDENABLE DILUENTS HENKEL CORPORATION (a Delaware corp.) (US) 1992-07-08 EP claimed