SCHEMBL9775815

SCHEMBL9775815

COC(CN(C)C(=O)CCCl)OC

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL1550865 0.84 ALDH1A1 (0.42) KMT2AALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL12969435 0.78 RXFP1 (0.33) MEN1KMT2ASMN1; SMN2
SCHEMBL9775766 0.76 TRPA1 (0.32) ALDH1A1
SCHEMBL28554513 0.76 AOC3 (0.33) MEN1KMT2A
SCHEMBL30154420 0.73 MCL1 (0.33) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL19813049 0.73 RXFP1 (0.35) SMN1; SMN2
SCHEMBL4439007 0.73 CHRM1 (0.37) SMN1; SMN2
SCHEMBL11006249 0.72 RXFP1 (0.30)
SCHEMBL10564226 0.71 CHRNB2 (0.35) SMN1; SMN2
SCHEMBL19751280 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4983748-A Chemical intermediates for polysaccharide aldehydes; wet strength paper additive NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1991-01-08 US disclosed
US-4804769-A PAPER ADDITIVES NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1989-02-14 US disclosed
EP-0175113-B1 POLYSACCHARIDE DERIVATIVES CONTAINING ALDEHYDE GROUPS, THEIR PREPARATION FROM THE CORRESPONDING ACETALS AND USE AS PAPER ADDITIVES National Starch and Chemical Corporation (US) 1988-10-12 EP disclosed
US-4741804-A Polysaccharide derivatives containing aldehyde groups, their preparation from the corresponding acetals and use as paper additives NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-05-03 US disclosed
US-4731162-A Polysaccharide derivatives containing aldehyde groups for use as paper additives NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-03-15 US disclosed
US-4703116-A WET STRENGTH, DRY STRENGTH NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1987-10-27 US disclosed
EP-0232851-A2 Polysaccaride derivatives containing aldehyde groups, corresponding acetals and use as paper additives National Starch and Chemical Investment Holding Corporation (US) 1987-08-19 EP disclosed
US-4675394-A Polysaccharide derivatives containing aldehyde groups, their preparation from the corresponding acetals and use as paper additives NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1987-06-23 US disclosed
EP-0175113-A2 Polysaccharide derivatives containing aldehyde groups, their preparation from the corresponding acetals and use as paper additives National Starch and Chemical Corporation (US) 1986-03-26 EP disclosed