SCHEMBL863498

SCHEMBL863498

CCCC(NC(=O)C(C#N)=Cc1cccc(Br)n1)c1ccc(OCCN(CC)CC)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP9X Q93008 11/20 0.71
UCHL1 P09936 1/20 0.71
USP5 P45974 1/20 0.71
STAT3 P40763 1/20 0.51
USP24 Q9UPU5 1/20 0.48
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
ACACB O00763 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
SCHEMBL863497 1.00 USP9X (0.71) USP9XUCHL1USP5STAT3USP24
SCHEMBL863758 0.93 USP9X (0.72) USP9XUCHL1USP5STAT3USP24
SCHEMBL863759 0.93 USP9X (0.72) USP9XUCHL1USP5STAT3USP24
SCHEMBL10124900 0.92 USP9X (0.78) USP9XUCHL1USP5STAT3USP24
SCHEMBL20171589 0.91 USP9X (0.57) USP9XUCHL1USP5STAT3USP24
SCHEMBL864787 0.90 USP9X (0.56) USP9XUCHL1USP5STAT3USP24
SCHEMBL864788 0.90 USP9X (0.56) USP9XUCHL1USP5STAT3USP24
SCHEMBL864756 0.87 USP9X (0.68) USP9XUCHL1USP5STAT3USP24
SCHEMBL864757 0.87 USP9X (0.68) USP9XUCHL1USP5STAT3USP24
SCHEMBL864195 0.87 USP9X (0.75) USP9XUCHL1USP5STAT3USP24

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140357673-A1 Deubiquitinase Inhibitors and Methods for Use of the Same UNIV MICHIGAN (US) 2014-12-04 US disclosed
US-8809377-B2 Deubiquitinase inhibitors and methods for use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-08-19 US disclosed
US-20120077806-A1 Deubiquitinase Inhibitors and Methods for Use of the Same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-03-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140357673-A1 Deubiquitinase Inhibitors and Methods for Use of the Same UCHL1, USP2, USP1 USP9X 33/4885UCHL1 1/4885USP5 19/4885
US-20120077806-A1 Deubiquitinase Inhibitors and Methods for Use of the Same UCHL1, USP2, USP1 USP9X 33/4885UCHL1 1/4885USP5 19/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.