SCHEMBL20171652

SCHEMBL20171652

C=C(NC(CCC)c1ccc(OCCN(C)CCNC)cc1)/C(C#N)=C/c1cccc(F)n1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP9X Q93008 10/20 0.45
UCHL1 P09936 1/20 0.41
USP5 P45974 1/20 0.41
USP24 Q9UPU5 1/20 0.38
SIGMAR1 Q99720 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
SCHEMBL20171606 0.89 USP9X (0.46) USP9XUCHL1USP5USP24
SCHEMBL20171604 0.88 USP9X (0.47) USP9XUCHL1USP5USP24
SCHEMBL882305 0.83 USP9X (0.54) USP9XUCHL1USP5USP24
SCHEMBL882194 0.82 USP9X (0.58) USP9XUCHL1USP5USP24
SCHEMBL20171649 0.82 USP9X (0.49) USP9XUCHL1USP5USP24
SCHEMBL882205 0.81 USP9X (0.57) USP9XUCHL1USP5USP24
SCHEMBL882298 0.81 USP9X (0.55) USP9XUCHL1USP5USP24
SCHEMBL20171593 0.81 USP9X (0.48) USP9XUCHL1USP5USP24
SCHEMBL20171559 0.80 USP9X (0.56) USP9XUCHL1USP5USP24
SCHEMBL20171615 0.80 USP9X (0.42) USP9XUCHL1USP5USP24

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