SCHEMBL863520

SCHEMBL863520

CCCC(NC(=O)C(C#N)=Cc1cccc(F)n1)c1ccc(OCCN2CCOCC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP9X Q93008 10/20 0.78
USP24 Q9UPU5 1/20 0.70
KMT2A Q03164 2/20 0.53
GAA P10253 2/20 0.53
UCHL1 P09936 1/20 0.52
USP5 P45974 1/20 0.52
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
GPR88 Q9GZN0 1/20 0.40
ACACB O00763 1/20 0.39

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
SCHEMBL863519 1.00 USP9X (0.78) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL864702 0.93 USP9X (0.68) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL864701 0.93 USP9X (0.68) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL882307 0.93 USP9X (0.67) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL882199 0.93 USP9X (0.67) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL20171592 0.92 USP9X (0.82) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL882207 0.91 USP9X (0.66) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL882293 0.91 USP9X (0.65) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL882302 0.90 USP9X (0.63) USP9XUSP24KMT2AGAAUCHL1
SCHEMBL10124919 0.89 USP9X (0.63) USP9XUSP24KMT2AGAAUCHL1

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 33/4885USP24 28/4885KMT2A 1328/4885
US-20120077806-A1 Deubiquitinase Inhibitors and Methods for Use of the Same UCHL1, USP2, USP1 USP9X 33/4885USP24 28/4885KMT2A 1328/4885

“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.