SCHEMBL20006802

SCHEMBL20006802

C=CC(=C/C)/C(C)=N\C(=C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL18600335 0.79 ALDH1A1 (0.32) ALDH1A1TP53TSHR
SCHEMBL16532307 0.70
SCHEMBL23396058 0.69
SCHEMBL23054234 0.67 ALDH1A1 (0.40) ALDH1A1TP53TSHR
SCHEMBL23189533 0.67
SCHEMBL20962181 0.67
SCHEMBL16378080 0.67
SCHEMBL24202556 0.65 ALDH1A1 (0.30) ALDH1A1TP53TSHR
SCHEMBL19071847 0.64
SCHEMBL19415072 0.64

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-3351644-B1 OXIDISING AGENT FOR MODIFIED NUCLEOTIDES CAMBRIDGE EPIGENETIX LTD (GB) 2020-01-29 EP disclosed
EP-2925883-B1 OXIDISING AGENT FOR MODIFIED NUCLEOTIDES CAMBRIDGE EPIGENETIX LTD (GB) 2018-03-28 EP disclosed