SCHEMBL18017565

SCHEMBL18017565

CCCC(NC(=O)/C(C#N)=C/c1nc(Cl)ccc1Cl)c1cccc(OCCN2CCCCC2)c1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP9X Q93008 10/20 0.73
USP24 Q9UPU5 1/20 0.73
UCHL1 P09936 1/20 0.44
USP5 P45974 1/20 0.44
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43
AVPR1B P47901 1/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 2/20 0.40
ESR1 P03372 2/20 0.39
ACACB O00763 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL18017555 0.92 USP9X (0.86) USP9XUSP24UCHL1USP5KDM4E
SCHEMBL18017557 0.86 USP9X (0.86) USP9XUSP24UCHL1USP5KDM4E
SCHEMBL18017556 0.85 USP9X (0.75) USP9XUSP24AVPR1BKDM4EPOLB
SCHEMBL16647263 0.85 USP9X (1.00) USP9XUSP24UCHL1USP5ACACB
SCHEMBL17986430 0.85 USP9X (1.00) USP9XUSP24UCHL1USP5ACACB
SCHEMBL18017563 0.84 USP9X (0.53) USP9XUSP24UCHL1USP5ROCK2
SCHEMBL18017567 0.84 USP9X (0.74) USP9XUSP24UCHL1USP5KMT2A
SCHEMBL18017561 0.83 USP9X (0.70) USP9XUSP24KDM4EPOLBESR1
SCHEMBL18017560 0.79 USP9X (0.87) USP9XUSP24UCHL1USP5AVPR1B
SCHEMBL16647252 0.78 USP9X (0.88) USP9XUSP24KDM4EACACBKMT2A

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
US-9868736-B2 Deubiquitinase inhibitors and methods for use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-01-16 US disclosed
US-20160237082-A1 DEUBIQUITINASE INHIBITORS AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2016-08-18 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 (1 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-20160237082-A1 DEUBIQUITINASE INHIBITORS AND METHODS FOR USE OF THE SAME USP1, UCHL1, USP2 USP9X 33/4885USP24 29/4885UCHL1 2/4885

“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.