SCHEMBL9858089

SCHEMBL9858089

C=C(CC(=O)OC(C(C)C)C1CO1)C(=O)OC(C(C)C)C1CO1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL9858094 0.88 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5161226 0.81 ALDH1A1 (0.37) ALDH1A1
SCHEMBL28060790 0.79 ALDH1A1 (0.43) ALDH1A1
SCHEMBL5161229 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL8430429 0.70 ALDH1A1 (0.53) ALDH1A1
SCHEMBL8644341 0.70 ALDH1A1 (0.57) ALDH1A1
SCHEMBL28806918 0.69 TSHR (0.36)
SCHEMBL481425 0.69 LMNA (0.39) ALDH1A1
SCHEMBL9858070 0.68 HCAR2 (0.39)
SCHEMBL9858038 0.68 HCAR2 (0.39)

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-0409992-A1 PROCESS FOR PRODUCING THERMOPLASTIC ELASTOMER MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-01-30 EP disclosed