SCHEMBL13724741

SCHEMBL13724741

CCS(=O)(=O)N1CCNC(C)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
NFKB1 P19838 1/20 0.40
PRKD3 O94806 1/20 0.40
PRKCG P05129 1/20 0.40
PRKCB P05771 1/20 0.40
PRKCA P17252 1/20 0.40
PRKCH P24723 1/20 0.40
PRKCI P41743 1/20 0.40
PRKCE Q02156 1/20 0.40
PRKCQ Q04759 1/20 0.40
PRKCZ Q05513 1/20 0.40
PRKCD Q05655 1/20 0.40
PRKD1 Q15139 1/20 0.40
BIRC2 Q13490 3/20 0.39
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
POLB P06746 2/20 0.34
ALOX15 P16050 1/20 0.34
SMYD3 Q9H7B4 3/20 0.32

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
SCHEMBL15716936 1.00 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
SCHEMBL28895018 0.83 BIRC2 (0.37) CYP3A4CYP2D6NFKB1PRKD3PRKCG
SCHEMBL325949 0.81 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
SCHEMBL1487170 0.81 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
SCHEMBL15360263 0.81 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
SCHEMBL16051991 0.81 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
Hydrochloric Acid SCHEMBL15716759 0.79 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
Hydrochloric Acid SCHEMBL15716760 0.79 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
Hydrochloric Acid SCHEMBL17439326 0.79 CYP3A4 (0.40) CYP3A4CYP2D6NFKB1PRKD3PRKCG
SCHEMBL13723516 0.78 CYP3A4 (0.39) CYP3A4CYP2D6NFKB1PRKD3PRKCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663533-B2 Thieno[3,2-C]pyridin-4(5H)-ones as BET inhibitors GLAXOSMITHKLINE LLC (US) 2017-05-30 US disclosed
EP-2920183-B1 THIENO[3,2-C]PYRIDIN-4(5H)-ONES AS BET INHIBITORS GLAXOSMITHKLINE LLC (US) 2017-03-08 EP disclosed
US-20160297832-A1 THIENO[3,2-C]PYRIDIN-4(5H)-ONES AS BET INHIBITORS GLAXOSMITHKLINE LLC 2016-10-13 US disclosed
EP-2920183-A1 THIENO[3,2-C]PYRIDIN-4(5H)-ONES AS BET INHIBITORS Glaxosmithkline LLC (US) 2015-09-23 EP disclosed
WO-2014078257-A1 THIENO[3,2-C]PYRIDIN-4(5H)-ONES AS BET INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-05-22 WO disclosed
EP-2699572-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP disclosed
WO-2012143143-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 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-20160297832-A1 THIENO[3,2-C]PYRIDIN-4(5H)-ONES AS BET INHIBITORS BRD4, BET1, BRD3 CYP3A4 2101/4885CYP2D6 1695/4885NFKB1 278/4885

“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.