SCHEMBL8090539

SCHEMBL8090539

C=CN(C=O)C1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 10/20 0.50
ADH1C P00326 7/20 0.50
ADH4 P08319 1/20 0.48
ADH1B P00325 1/20 0.40

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
SCHEMBL8087373 0.98 ADH1A (0.50) ADH1AADH1CADH4ADH1B
SCHEMBL8092201 0.98 ADH1A (0.50) ADH1AADH1CADH4ADH1B
SCHEMBL28922126 0.90
SCHEMBL7430076 0.87 ADH1A (0.63) ADH1AADH1CADH4ADH1B
SCHEMBL6804942 0.84
SCHEMBL15806297 0.71 ADH1A (0.32) ADH1AADH1CADH4
SCHEMBL23838311 0.70 ADH1A (0.32) ADH1AADH1C
SCHEMBL15806424 0.70 ADH1A (0.35) ADH1AADH1CADH1B
SCHEMBL21418063 0.70 ADH1A (0.35) ADH1AADH1CADH1B
SCHEMBL22854655 0.70 ADH1A (0.31) ADH1AADH1C

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
EP-1050565-A2 Method of hydrophobisation and preparations for carrying out said method BASF AKTIENGESELLSCHAFT (DE) 2000-11-08 EP disclosed