SCHEMBL2363326

SCHEMBL2363326

C=CC(C)CCCCNC=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 5/20 0.46
ADH1A P07327 5/20 0.46
ADH7 P40394 4/20 0.46
ADH1C P00326 4/20 0.46
ADH4 P08319 2/20 0.45
EPHX1 P07099 1/20 0.45

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
SCHEMBL8186479 0.78 ADH1B (0.54) ADH1BADH1AADH7ADH1CADH4
SCHEMBL19935801 0.77 EPHX1 (0.41) EPHX1
SCHEMBL11153834 0.76 ADH1B (0.56) ADH1BADH1AADH7ADH1CADH4
SCHEMBL14937478 0.76 ADH1B (0.56) ADH1BADH1AADH7ADH1CADH4
SCHEMBL11568445 0.76 ADH1B (0.56) ADH1BADH1AADH7ADH1CADH4
SCHEMBL11354637 0.76 ADH1B (0.56) ADH1BADH1AADH7ADH1CADH4
SCHEMBL11569625 0.76 ADH1B (0.56) ADH1BADH1AADH7ADH1CADH4
SCHEMBL11413206 0.74 ADH1B (0.50) ADH1BADH1AADH7ADH1CADH4
SCHEMBL12519632 0.74 ADH1B (0.50) ADH1BADH1AADH7ADH1CADH4
SCHEMBL20821943 0.73 ADH1B (0.37) ADH1BADH1AADH7ADH1CADH4

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
WO-2011084993-A1 POLYMERS PREPARED FROM MIXTURES OF MULTIFUNCTIONAL N-VINYLFORMAMIDE AND HYBRID REACTIVE N-VINYLFORMAMIDE CROSSLINKING MONOMER MOIETIES AND USES THEREOF ISP INVESTMENTS INC. (US) 2011-07-14 WO disclosed