SCHEMBL28624382

SCHEMBL28624382

C=C(C)C(=O)OC(Cc1ccc(OCC)cc1)C(O)c1ccc(OCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 17/20 0.43
ACACA Q13085 1/20 0.41

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
SCHEMBL28617970 0.91 ACACB (0.45) ACACB
SCHEMBL28635202 0.88 LDHA (0.47) ACACB
SCHEMBL28621093 0.85 THRB (0.44)
SCHEMBL28629138 0.84 ACACB (0.44) ACACB
SCHEMBL28629141 0.82 ACACB (0.48) ACACB
SCHEMBL28629139 0.74 NQO1 (0.48) ACACB
SCHEMBL28727742 0.73 TSHR (0.41) ACACBACACA
SCHEMBL455205 0.72 ALDH1A1 (0.49) ACACB
SCHEMBL19944334 0.72 LMNA (0.46)
SCHEMBL11603750 0.72 NQO1 (0.64) ACACB

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
CN-109641831-B Monomers, polymers, preparation method and use thereof 东莞东阳光医疗智能器件研发有限公司 2021-09-10 CN disclosed