SCHEMBL284110

SCHEMBL284110

COCCCn1nc(C(C)(C)C)cc1N

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.40
CNR2 P34972 6/20 0.40
KDM4E B2RXH2 2/20 0.39
TLR7 Q9NYK1 1/20 0.36
CDK9 P50750 1/20 0.34
DYRK1A Q13627 1/20 0.34
DYRK2 Q92630 1/20 0.34
GRN P28799 4/20 0.33
SORT1 Q99523 4/20 0.33
ALDH1A1 P00352 1/20 0.33
REN P00797 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TP53 P04637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL16279245 0.90 KDM4E (0.41) CNR1CNR2KDM4EGRNSORT1
SCHEMBL282922 0.82 CNR1 (0.49) CNR1CNR2KDM4EGRNSORT1
SCHEMBL15007149 0.81 CNR1 (0.42) CNR1CNR2KDM4EGRNSORT1
SCHEMBL284028 0.81 CNR1 (0.55) CNR1CNR2KDM4E
SCHEMBL17980904 0.79 POLB (0.45) KDM4ETLR7CDK9DYRK1ADYRK2
SCHEMBL283910 0.78 KDM4E (0.44) CNR1CNR2KDM4EGRNSORT1
SCHEMBL283715 0.78 KDM4E (0.39) CNR1CNR2KDM4ECDK9DYRK1A
SCHEMBL21960877 0.78 NR3C1 (0.35) TLR7CDK9DYRK1ADYRK2ALDH1A1
SCHEMBL1924672 0.77 KDM4E (0.42) CNR1CNR2KDM4EGRNSORT1
SCHEMBL25488149 0.76 KDM4E (0.37) CNR1CNR2KDM4EGRNSORT1

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 10 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
EP-2411370-B1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBVIE INC (US) 2015-04-22 EP disclosed
US-8859596-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2014-10-14 US disclosed
US-8288428-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2012-10-16 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-20100249087-A1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-09-30 US 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 (3 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 CNR1 1/4885CNR2 2/4885KDM4E 1649/4885
US-20100069349-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R CNR1 1/4885CNR2 2/4885KDM4E 1649/4885
US-20100249087-A1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 CNR1 1/4885CNR2 2/4885KDM4E 2286/4885

“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.