SCHEMBL8764950

SCHEMBL8764950

C=C(CC1CCC2OC2C1)C(=O)OCC1CCC2OC2C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL14372021 0.88 ALDH1A1 (0.32) ALDH1A1
SCHEMBL6708803 0.87 PPM1B (0.35) ALDH1A1
SCHEMBL7189831 0.87 PPM1B (0.41) ALDH1A1
SCHEMBL259201 0.85 PPM1B (0.35) ALDH1A1
SCHEMBL350303 0.83 PPM1B (0.36) ALDH1A1
SCHEMBL8191572 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL195791 0.83 ALDH1A1 (0.50) ALDH1A1
SCHEMBL19184269 0.83 ALDH1A1 (0.32) ALDH1A1
SCHEMBL22392876 0.81 LMNA (0.34)
SCHEMBL11029298 0.81 PPM1B (0.36)

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-0643112-B1 Curable composition, thermal latent acid catalyst, method of coating, coated article, method of molding and molded article NOF CORP (JP) 1997-07-30 EP disclosed