SCHEMBL4878352

SCHEMBL4878352

CO/N=C(\c1ccc(=O)n(-c2c(Cl)cccc2Cl)c1)c1ccc(F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.35
HSD11B1 P28845 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
RORC P51449 2/20 0.33
PYGL P06737 2/20 0.33
P2RX7 Q99572 2/20 0.33
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 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
SCHEMBL4878366 1.00 MAPK14 (0.35) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4876187 0.93 MAPK14 (0.38) MAPK14RORC
SCHEMBL4876194 0.93 MAPK14 (0.38) MAPK14RORC
SCHEMBL4878301 0.87 RXRA (0.33) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4878297 0.87 RXRA (0.33) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4877829 0.87 HSD11B1 (0.37) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4877832 0.87 HSD11B1 (0.37) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4868857 0.86 HSD11B1 (0.32) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4868860 0.86 HSD11B1 (0.32) MAPK14HSD11B1KDM4EPOLBRORC
SCHEMBL4875306 0.84 HSD11B1 (0.31) MAPK14HSD11B1KDM4EPOLBRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080081825-A1 Nitrogen-Containing Heterocyclic Compounds and Medicinal Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-04-03 US disclosed
EP-1741702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-10 EP 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-20080081825-A1 Nitrogen-Containing Heterocyclic Compounds and Medicinal Use Thereof MAPK1, NOS1, NOS2 MAPK14 13/4885HSD11B1 544/4885KDM4E 3574/4885

“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.