SCHEMBL8658486

SCHEMBL8658486

C=CCN(C)[C@H](CCC(N)=O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.40
KMT2A Q03164 2/20 0.40
ALOX15 P16050 1/20 0.40
PMP22 Q01453 1/20 0.40
ALDH1A1 P00352 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MEN1 O00255 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 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
SCHEMBL5696078 1.00 BLM (0.40) BLMKMT2AALOX15PMP22ALDH1A1
SCHEMBL5696080 1.00 BLM (0.40) BLMKMT2AALOX15PMP22ALDH1A1
SCHEMBL28959979 0.83 BLM (0.42) BLMKMT2AALOX15PMP22ALDH1A1
SCHEMBL28959981 0.83 BLM (0.42) BLMKMT2AALOX15PMP22ALDH1A1
SCHEMBL759009 0.81 BLM (0.41) BLMKMT2AALOX15PMP22ALDH1A1
SCHEMBL1843778 0.81 BLM (0.41) BLMKMT2AALOX15PMP22ALDH1A1
SCHEMBL17772936 0.79 ALOX15 (0.45) BLMKMT2AALOX15PMP22SLC6A3
SCHEMBL27743771 0.77 GPR84 (0.42) ALDH1A1
SCHEMBL23037168 0.76 KMT2A (0.50) BLMKMT2AALOX15PMP22
SCHEMBL197387 0.76 KMT2A (0.50) BLMKMT2AALOX15PMP22

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5710332-A N-ALKYL-N-METHYLGLYCAMINE N-OXIDE AND PREPARATION ALBRIGHT & WILSON LIMITED (GB) 1998-01-20 US disclosed
EP-0569904-B1 Process for the preparation of carbohydrate derived surfactants and their precursors ALBRIGHT & WILSON UK LTD (GB) 1997-04-02 EP disclosed
US-5523478-A Carbohydrate-derived surfactants and their precursors ALBRIGHT & WILSON LIMITED (GB) 1996-06-04 US disclosed
EP-0569904-A2 Process for the preparation of carbohydrate derived surfactants and their precursors ALBRIGHT & WILSON UK LIMITED (GB) 1993-11-18 EP disclosed