SCHEMBL9539891

SCHEMBL9539891

CC(C)(C)C(=O)C1CNCCOCCOCCNCCOCCO1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 16/20 0.43
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
CYP2C9 P11712 1/20 0.34
SSTR1 P30872 1/20 0.33
SSTR2 P30874 1/20 0.33
SSTR3 P32745 1/20 0.33
SSTR5 P35346 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
SCHEMBL800687 0.88 SSTR4 (0.51) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL25017480 0.88 SSTR4 (0.51) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL22570071 0.88 SSTR4 (0.51) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL9539687 0.85 SSTR4 (0.39) SSTR4MEN1KMT2ASSTR1SSTR2
SCHEMBL4630984 0.75 SSTR4 (0.49) SSTR4SSTR1SSTR2SSTR3SSTR5
Morpholine SCHEMBL28052158 0.72 SSTR4 (0.40) SSTR4MEN1KMT2AKDM4EGAA
SCHEMBL7320155 0.72 SSTR4 (0.45) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL800762 0.70 SSTR4 (0.44) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL3908546 0.70 SSTR4 (0.44) SSTR4
Morpholine SCHEMBL28231194 0.69 SSTR4 (0.38) SSTR4MEN1KMT2AKDM4EGAA

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
WO-1993004142-A1 STABILIZED COMPLEX LIGANDS AND THEIR USE IN LIQUID CRYSTAL DISPLAYS HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-04 WO disclosed