SCHEMBL8470775

SCHEMBL8470775

NCCOCCO.NOCCOCCO

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
TSHR P16473 3/20 0.50
MAPK1 P28482 1/20 0.50
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
ODC1 P11926 1/20 0.38
ALDH1A1 P00352 2/20 0.36
APP P05067 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
SCHEMBL28443003 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL31395676 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16329524 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL15500293 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL21479469 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL39999 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL3177549 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL3182791 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16329522 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL313703 0.89 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB

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-5861051-A SEPARATING HYDROGEN SULFIDE USING AQUEOUS SOLUTION OF METHYLDIETHANOLAMINE AND 2-(2-AMINOETHOXY)ETHANOL; SWEETENING; NO RECLAMATION; BY-PRODUCT INHIBITION HUNTSMAN PETROCHEMICAL CORPORATION (US) 1999-01-19 US disclosed