SCHEMBL20171494

SCHEMBL20171494

CCCC(NC(=O)/C(C#N)=C/c1ncncn1)/C(C)=C/C=C(\C)OCCOCCN

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
USP9X Q93008 3/20 0.31
UCHL1 P09936 1/20 0.31
USP5 P45974 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL20171590 0.68 USP9X (0.40) USP9XUCHL1USP5
SCHEMBL734430 0.53 HRH3 (0.44)
SCHEMBL24311035 0.51 ALDH1A1 (0.35)
SCHEMBL5317764 0.51 ALDH1A1 (0.60)
SCHEMBL4381504 0.51 ALDH1A1 (0.60)
SCHEMBL151434 0.51 ALDH1A1 (0.60)
SCHEMBL22276519 0.51 ALDH1A1 (0.60)
SCHEMBL21100449 0.50 GABRR1 (0.34)
SCHEMBL27116456 0.50 CHRNA1 (0.35)
Hydrochloric Acid SCHEMBL7387030 0.49 ALDH1A1 (0.58)

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-2619184-B1 DEUBIQUITINASE INHIBITORS AND METHODS FOR USE OF THE SAME UNIV MICHIGAN REGENTS (US) 2018-05-23 EP disclosed