SCHEMBL5010238

SCHEMBL5010238

COc1cc(NC(=O)C(=O)NC(C)(C)COc2ccc(C#N)cc2)ccc1-c1cnco1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 16/20 0.71
IMPDH1 P20839 6/20 0.68
AAK1 Q2M2I8 5/20 0.54

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
SCHEMBL5010873 0.93 IMPDH2 (0.68) IMPDH2IMPDH1AAK1
SCHEMBL5010857 0.92 IMPDH2 (0.67) IMPDH2IMPDH1AAK1
SCHEMBL5010852 0.89 IMPDH2 (0.73) IMPDH2IMPDH1AAK1
SCHEMBL1474041 0.87 IMPDH2 (0.77) IMPDH2IMPDH1AAK1
SCHEMBL5010905 0.86 IMPDH2 (0.66) IMPDH2IMPDH1AAK1
SCHEMBL6486099 0.85 IMPDH2 (0.67) IMPDH2IMPDH1AAK1
SCHEMBL6499382 0.85 IMPDH2 (0.64) IMPDH2IMPDH1
SCHEMBL5013919 0.84 IMPDH2 (0.74) IMPDH2IMPDH1AAK1
SCHEMBL1473286 0.84 IMPDH2 (1.00) IMPDH2IMPDH1AAK1
SCHEMBL1474188 0.84 IMPDH2 (0.85) IMPDH2IMPDH1AAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6867299-B2 Inosine monophosphate dehydrogenase (IMPDH); use as immunosuppressants, anticancer agents and antiviral agents HOFFMANN-LA ROCHE INC. (US) 2005-03-15 US claimed
EP-2803357-B1 Angiogenesis inhibitors UNIV JOHNS HOPKINS (US) 2020-11-18 EP disclosed
US-9642865-B2 Angiogenesis inhibitors THE JOHNS HOPKINS UNIVERSITY (US) 2017-05-09 US disclosed
US-8980930-B2 Angiogenesis inhibitors THE JOHNS HOPKINS UNIVERSITY (US) 2015-03-17 US disclosed
US-20150056267-A1 ANGIOGENESIS INHIBITORS UNIV JOHNS HOPKINS (US) 2015-02-26 US disclosed
EP-2803357-A2 Angiogenesis inhibitors THE JOHNS-HOPKINS UNIVERSITY (US) 2014-11-19 EP disclosed
US-20130101657-A1 ANGIOGENESIS INHIBITORS THE JOHNS HOPKINS UNIVERSITY (US) 2013-04-25 US disclosed
US-20080193499-A1 Angiogenesis Inhibitors THE JOHNS HOPKINS UNIVERSITY (US) 2008-08-14 US disclosed
US-6867299-B2 Inosine monophosphate dehydrogenase (IMPDH); use as immunosuppressants, anticancer agents and antiviral agents HOFFMANN-LA ROCHE INC. (US) 2005-03-15 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 (3 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-20150056267-A1 ANGIOGENESIS INHIBITORS FLT1, VEGFA, FLT4 IMPDH2 2862/4885IMPDH1 2706/4885AAK1 793/4885
US-20080193499-A1 Angiogenesis Inhibitors FLT1, VEGFA, FLT4 IMPDH2 2862/4885IMPDH1 2706/4885AAK1 793/4885
US-20130101657-A1 ANGIOGENESIS INHIBITORS FLT1, VEGFA, FLT4 IMPDH2 2862/4885IMPDH1 2706/4885AAK1 793/4885

“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.