SCHEMBL24345590

SCHEMBL24345590

OC1CCOc2c(Cl)cc(C3OCCO3)cc21

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.43

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
SCHEMBL29457617 1.00 MAP3K14 (0.43) MAP3K14
SCHEMBL24345594 0.78 MAP3K14 (0.45) MAP3K14
SCHEMBL24345592 0.74 MAP3K14 (0.42) MAP3K14
SCHEMBL29457640 0.74 MAP3K14 (0.42) MAP3K14
SCHEMBL6026797 0.70 MAP3K14 (0.51) MAP3K14
SCHEMBL29457638 0.69
SCHEMBL6058540 0.68
SCHEMBL16396399 0.68 MAP3K14 (0.49) MAP3K14
SCHEMBL13506868 0.67 MAP3K14 (0.51) MAP3K14
SCHEMBL25166053 0.65 MAP3K14 (0.49) MAP3K14

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-3981773-A1 DYNAMIC KINETIC RESOLUTION OF ALCOHOLS BY ENANTIOSELECTIVE SILYLATION Technische Universität Berlin (DE) 2022-04-13 EP disclosed