SCHEMBL13837643

SCHEMBL13837643

CCOC(=O)c1c(-c2ccc(Cl)cc2)csc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 7/20 0.58
TP53 P04637 3/20 0.57
PTPN1 P18031 5/20 0.57
PTPRC P08575 2/20 0.57
PTPN2 P17706 2/20 0.57
PTPA Q15257 2/20 0.57
MAPT P10636 3/20 0.55
PTPRF P10586 1/20 0.55
PRKCZ Q05513 2/20 0.54
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL13837701 0.85 ANO1 (0.73) ANO1TP53PTPN1PTPRCPTPN2
SCHEMBL13837658 0.79 PRKCZ (0.66) TP53PTPN1PTPRCPTPN2PTPA
SCHEMBL3629702 0.78 TP53 (0.82) ANO1TP53PTPN1PTPRCPTPN2
SCHEMBL14123489 0.77 PRKCZ (0.63) TP53PTPN1PTPRCPTPN2PTPA
SCHEMBL13837924 0.77 TP53 (0.53) TP53PTPN1PTPRCPTPN2PTPA
SCHEMBL21247385 0.77 TP53 (0.72) TP53PTPN1PTPRCPTPN2PTPA
SCHEMBL7128260 0.77 MAPT (0.63) TP53MAPTALDH1A1LMNANPSR1
SCHEMBL3629109 0.75 MAPT (0.72) TP53PTPN1PTPRCPTPN2PTPA
SCHEMBL3627300 0.75 MAPT (0.72) TP53PTPN1PTPRCPTPN2PTPA
SCHEMBL8288762 0.75 PRKCZ (0.67) TP53PTPN1PTPRCPTPN2PTPA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889672-B2 Compounds, formulations, and methods of protein kinase C inhibition THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-11-18 US disclosed
US-8889672-B2 Compounds, formulations, and methods of protein kinase C inhibition THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-11-18 US disclosed
US-20120302561-A1 Compounds, Formulations, and Methods of Protein Kinase C Inhibition THE PENN STATE RESEARCH FOUNDATION (US) 2012-11-29 US disclosed
WO-2012149452-A1 COMPOUNDS, FORMULATIONS, AND METHODS OF PROTEIN KINASE C INHIBITION REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-11-01 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-20120302561-A1 Compounds, Formulations, and Methods of Protein Kinase C Inhibition PRKCA, PRKCH, PRKCI ANO1 1115/4885TP53 553/4885PTPN1 1256/4885

“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.