SCHEMBL4869004

SCHEMBL4869004

CC(C)(C)OC(=O)N1CCC(O/N=C(\c2ccc(=O)n(-c3c(Cl)cccc3Cl)c2)c2ccc(F)cc2F)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR119 Q8TDV5 3/20 0.38
HSD11B1 P28845 1/20 0.38
STS P08842 1/20 0.38
MAPT P10636 3/20 0.38
TP53 P04637 2/20 0.38
HPGDS O60760 1/20 0.37
MAPK14 Q16539 1/20 0.37
LMNA P02545 2/20 0.37

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
SCHEMBL4869007 1.00 SMN1; SMN2 (0.38) SMN1; SMN2MEN1KMT2AGPR119HSD11B1
SCHEMBL4874068 0.91 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2AGPR119HSD11B1
SCHEMBL5183074 0.91 MAPT (0.38) SMN1; SMN2MEN1KMT2AGPR119HSD11B1
SCHEMBL4874063 0.91 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2AGPR119HSD11B1
SCHEMBL5183064 0.91 MAPT (0.38) SMN1; SMN2MEN1KMT2AGPR119HSD11B1
SCHEMBL4868322 0.90 HSD11B1 (0.41) KMT2AHSD11B1MAPK14LMNA
SCHEMBL4868318 0.90 HSD11B1 (0.41) KMT2AHSD11B1MAPK14LMNA
SCHEMBL4873293 0.88 MAPK14 (0.48) HSD11B1MAPK14
SCHEMBL4873287 0.88 MAPK14 (0.48) HSD11B1MAPK14
SCHEMBL4876874 0.87 KMT2A (0.40) MEN1KMT2AHSD11B1MAPK14

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 SMN1; SMN2 3234/4885MEN1 2673/4885KMT2A 3886/4885

“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.