SCHEMBL9904140

SCHEMBL9904140

Cc1ccc(S(=O)(=O)NN=C2CCNC(=O)c3oc4ccc(O)cc4c32)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 4/20 0.45
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
TP53 P04637 1/20 0.45
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45
PRKD2 Q9BZL6 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HTR6 P50406 2/20 0.40
HTR1A P08908 1/20 0.40
HTR2A P28223 1/20 0.40
HTR7 P34969 1/20 0.40
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
MAOB P27338 1/20 0.37
BCAT1 P54687 1/20 0.35
CYTH2 Q99418 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL9920388 1.00 PRKD1 (0.45) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL17384887 0.86 PRKD1 (0.47) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL9904133 0.77 ALDH1A1 (0.50) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL9920723 0.77 ALDH1A1 (0.50) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL17384886 0.73 PRKD1 (0.53) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL9904264 0.73 PRKD1 (0.64) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL15472031 0.71 PRKD1 (0.61) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL19696351 0.71 PRKD1 (0.61) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL9904109 0.69 PRKD1 (0.48) PRKD1ALDH1A1LMNAHTTTP53
SCHEMBL9920805 0.69 PRKD1 (0.48) PRKD1ALDH1A1LMNAHTTTP53

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-9840515-B2 Protein kinase D inhibitors University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2017-12-12 US disclosed
US-20140045821-A1 PROTEIN KINASE D INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2014-02-13 US disclosed
WO-2012078859-A2 PROTEIN KINASE D INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-06-14 WO 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-20140045821-A1 PROTEIN KINASE D INHIBITORS PRKCD, PRKD1, PRKD2 PRKD1 2/4885ALDH1A1 4548/4885LMNA 3108/4885

“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.