SCHEMBL9714722

SCHEMBL9714722

CCN(CC)C[CH]CCN(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6268580 0.84
SCHEMBL5948658 0.80 MEN1 (0.34) MEN1POLBKMT2A
SCHEMBL3739677 0.80 TSHR (0.32)
SCHEMBL5948823 0.78 MEN1 (0.33) MEN1POLBKMT2A
SCHEMBL6024523 0.76 KCNH2 (0.39) MEN1POLBKMT2A
SCHEMBL5949135 0.76 TSHR (0.38)
SCHEMBL2154947 0.76 MEN1 (0.37) MEN1POLBKMT2A
SCHEMBL6024521 0.76 KCNH2 (0.39) MEN1POLBKMT2A
SCHEMBL11756439 0.75 ALDH1A1 (0.38)
SCHEMBL10937403 0.74 MAPK1 (0.34) MEN1POLBKMT2A

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
US-5116402-A HERBICIDAL COMPOSITION CONTAINING DIOXOLANE, DIOXANE, OR DIOXEPANE DERIVATIVES AS ANTIDOTE MAGYAR TUDOMANVOS AKADEMIA KOZPONTI KEMIAI KUTATO INTEZETE NITROKEMIA INARTELENEK FUZFOGYARTELEP (HU) 1992-05-26 US disclosed