SCHEMBL20171909

SCHEMBL20171909

N#CC1(/N=N/C2(C#N)CCCCC2)CCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL5597706 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL33334 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL5911917 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL3863192 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL5911915 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL3792642 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL11294910 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL5597914 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL22087942 1.00 ALDH1A1 (0.46) ALDH1A1
SCHEMBL491398 1.00 ALDH1A1 (0.46) ALDH1A1

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-2889334-B1 FLAKED GRAPHITE RESIN COMPOSITE MATERIAL AND METHOD FOR PRODUCING SAME SEKISUI CHEMICAL CO LTD (JP) 2018-05-23 EP disclosed