SCHEMBL284523

SCHEMBL284523

CC(C)(C)c1cc(N)n(CCC(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
GRN P28799 4/20 0.35
SORT1 Q99523 4/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK14 Q16539 2/20 0.34
CNR2 P34972 3/20 0.33
CNR1 P21554 2/20 0.33
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.30
CDK9 P50750 1/20 0.30
DYRK1A Q13627 1/20 0.30
DYRK2 Q92630 1/20 0.30
KDM4C Q9H3R0 1/20 0.30

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
SCHEMBL283715 0.90 KDM4E (0.39) KDM4EGRNSORT1ALDH1A1MAPK14
SCHEMBL15069908 0.86 KDM4E (0.42) KDM4EGRNSORT1ALDH1A1MAPK14
SCHEMBL283910 0.81 KDM4E (0.44) KDM4EGRNSORT1ALDH1A1MAPK14
SCHEMBL1924672 0.79 KDM4E (0.42) KDM4EGRNSORT1ALDH1A1MAPK14
SCHEMBL22505758 0.78 KDM4E (0.41) KDM4EGRNSORT1ALDH1A1MAPK14
SCHEMBL282922 0.78 CNR1 (0.49) KDM4EGRNSORT1MAPK14CNR2
SCHEMBL3843249 0.77 KDM4E (0.46) KDM4EGRNSORT1ALDH1A1CNR2
SCHEMBL284028 0.77 CNR1 (0.55) KDM4ECNR2CNR1
SCHEMBL15007149 0.77 CNR1 (0.42) KDM4EGRNSORT1ALDH1A1MAPK14
SCHEMBL16279245 0.77 KDM4E (0.41) KDM4EGRNSORT1ALDH1A1CNR2

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
EP-2428507-B1 Cannabinoid receptor ligands ABBVIE BAHAMAS LTD (BS) 2015-10-21 EP disclosed
EP-2896615-A1 Cannabinoid receptor ligands AbbVie Bahamas Limited (BS) 2015-07-22 EP disclosed
US-8859596-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2014-10-14 US disclosed
US-8188135-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
EP-2428507-A2 Cannabinoid receptor ligands Abbott Laboratories (US) 2012-03-14 EP disclosed
US-20100069348-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-03-18 US disclosed
US-20100069349-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-03-18 US 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 (2 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-20100069348-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R KDM4E 1649/4885GRN 3283/4885SORT1 3951/4885
US-20100069349-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R KDM4E 1649/4885GRN 3283/4885SORT1 3951/4885

“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.