SCHEMBL6852961

SCHEMBL6852961

C=C(C)C(=O)N(O)C1CCCCC1.C=C(CC)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
ALOX5 P09917 3/20 0.33
ADH1C P00326 1/20 0.30
ADH1A P07327 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
SCHEMBL3885312 0.84 ADH1A (0.34) TDP1ADH1CADH1A
SCHEMBL4247300 0.81 ADH1A (0.33) ALOX5ADH1CADH1A
SCHEMBL28108645 0.75 TDP1 (0.63) TDP1
SCHEMBL22160155 0.73 TDP1 (0.39) TDP1
SCHEMBL10777585 0.69 L3MBTL1 (0.45) ADH1CADH1A
SCHEMBL472559 0.69
SCHEMBL98826 0.68 TSHR (0.41) TDP1ADH1CADH1A
SCHEMBL10475740 0.68 L3MBTL1 (0.42) ADH1CADH1A
SCHEMBL17888742 0.68 ADH1A (0.35) TDP1ADH1CADH1A
SCHEMBL12198758 0.67 L3MBTL1 (0.43) ADH1CADH1A

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-6815137-B2 PRODUCING HYDROPHOBIC POLYMER FINE PARTICLES HAVING A HIGHLY HYDROPHILIC SURFACE. FUJI PHOTO FILM CO., LTD. (JP) 2004-11-09 US disclosed