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SCHEMBL20112925

SCHEMBL20112925

CN(CCCCCCN(C=O)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ADH1A P07327 3/20 0.46
▸ ADH1C P00326 2/20 0.46
▸ ADH4 P08319 1/20 0.46
▸ ALOX15 P16050 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
SCHEMBL20200266 0.94 ADH1A (0.51) ADH1AADH1CADH4ALOX15
SCHEMBL77345 0.94 ADH1A (0.51) ADH1AADH1CADH4ALOX15
SCHEMBL14263284 0.94 ADH1A (0.51) ADH1AADH1CADH4ALOX15
SCHEMBL14142383 0.89 ADH1A (0.44) ADH1AADH1CADH4ALOX15
SCHEMBL3840058 0.88 ADH1A (0.63) ADH1AADH1CADH4
SCHEMBL3836040 0.88 ADH1A (0.63) ADH1AADH1CADH4
SCHEMBL3841076 0.88 ADH1A (0.63) ADH1AADH1CADH4
SCHEMBL3842003 0.88 ADH1A (0.63) ADH1AADH1CADH4
SCHEMBL3840011 0.88 ADH1A (0.63) ADH1AADH1CADH4
SCHEMBL4092337 0.86 ADH1A (0.40) ADH1AADH1CADH4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3230380-B1 POLYAMIDE COMPOSITIONS COMPRISING A POLYAMIDE 6,6 AND A BLEND OF HIGH CHAIN-LENGTH POLYAMIDES, USE THEREOF, AND ARTICLES OBTAINED THEREFROM PERFORMANCE POLYAMIDES S A S (FR) 2020-03-25 — — EP disclosed
EP-3046965-B1 POLYAMIDE BASED COMPOSITION CONTAINING POLYKETONE AND RUBBER RHODIA OPERATIONS (FR) 2018-05-02 — — EP disclosed