SCHEMBL1499951

SCHEMBL1499951

NC(CCOCCC(N)OCCO)OCCO

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
MAPK1 P28482 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL3284313 0.89 TSHR (0.45) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL22283562 0.84
SCHEMBL27618969 0.80
Ethylene Glycol SCHEMBL27361418 0.78 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL27535378 0.78 MEN1 (0.46) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL28738510 0.78 MEN1 (0.46) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL27438323 0.78 MEN1 (0.46) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL7169036 0.77 TSHR (0.38) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL2891020 0.76
SCHEMBL27912359 0.75 TSHR (0.43) TSHRMAPK1MEN1KMT2AALDH1A1

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
JP-2011057584-A MANUFACTURING METHOD AND PURIFICATION METHOD OF (S)-2-(4-METHOXY-BENZENESULFONYLAMINO)-N-(METHOXYPOLYETHOXYETHYL)-SUCCINAMIC ACID-t-BUTYL ESTER TAOKA CHEM CO LTD 2011-03-24 JP disclosed