SCHEMBL4868322

SCHEMBL4868322

CC(=O)N1CCC(ON=C(c2ccc(=O)n(-c3c(Cl)cccc3Cl)c2)c2ccc(F)cc2F)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 11/20 0.41
MGLL Q99685 1/20 0.36
MAPK14 Q16539 2/20 0.36
P2RX7 Q99572 2/20 0.35
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34
OPRL1 P41146 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
SCHEMBL4868318 1.00 HSD11B1 (0.41) HSD11B1MGLLMAPK14P2RX7LMNA
Hydrochloric Acid SCHEMBL4876078 0.92 HSD11B1 (0.38) HSD11B1MGLLMAPK14P2RX7LMNA
Hydrochloric Acid SCHEMBL4876082 0.92 HSD11B1 (0.38) HSD11B1MGLLMAPK14P2RX7LMNA
SCHEMBL4876884 0.91 KMT2A (0.40) HSD11B1MAPK14P2RX7KMT2A
SCHEMBL4876874 0.91 KMT2A (0.40) HSD11B1MAPK14P2RX7KMT2A
SCHEMBL4869007 0.90 SMN1; SMN2 (0.38) HSD11B1MAPK14LMNAKMT2A
SCHEMBL4869004 0.90 SMN1; SMN2 (0.38) HSD11B1MAPK14LMNAKMT2A
SCHEMBL4868838 0.90 DRD4 (0.37) HSD11B1MAPK14P2RX7
SCHEMBL4868846 0.90 DRD4 (0.37) HSD11B1MAPK14P2RX7
SCHEMBL4877782 0.89 MAPK14 (0.38) HSD11B1MAPK14

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 HSD11B1 544/4885MGLL 4330/4885MAPK14 13/4885

“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.