SCHEMBL9871235

SCHEMBL9871235

CC1CN(C(C)C2COC3(CCC(C(C)(C)C)CC3)O2)CC(C)O1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL9522193 1.00 MEN1 (0.32) MEN1KMT2ASMN1; SMN2
SCHEMBL10463277 0.95 MEN1 (0.30) MEN1KMT2ASMN1; SMN2
SCHEMBL9521322 0.75
SCHEMBL15756127 0.73
SCHEMBL10487093 0.73 GAA (0.41) MEN1KMT2ASMN1; SMN2
SCHEMBL9520485 0.72
SCHEMBL9741876 0.71 MEN1 (0.36) MEN1KMT2ASMN1; SMN2
SCHEMBL20588782 0.69
SCHEMBL9872374 0.69
SCHEMBL9873129 0.68 KMT2A (0.31) MEN1KMT2A

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-4985421-A Fungicidal substituted dioxolanylethylamine BAYER AKTIENGESELLSCHAFT (DE) 1991-01-15 US disclosed