SCHEMBL28939552

SCHEMBL28939552

CC1=CCC(O)(C(C)(C)O)C=C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 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
SCHEMBL4369108 0.86 HSD11B1 (0.33) HSD11B1
SCHEMBL28175714 0.80 HSD11B1 (0.32) HSD11B1
SCHEMBL231670 0.72
SCHEMBL2466483 0.70
SCHEMBL8337731 0.70
SCHEMBL29264263 0.68
SCHEMBL29518186 0.67 HSD11B1 (0.33) HSD11B1
SCHEMBL16336297 0.65
SCHEMBL11800789 0.65
SCHEMBL29086601 0.65 HSD11B1 (0.39) HSD11B1

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-114524704-A Method for synthesizing p-cymene 南平青华科技有限公司 2022-05-24 CN disclosed