SCHEMBL288529

SCHEMBL288529

CC(C)(C)c1cc(NC(=O)c2cc(C(F)(F)F)ccc2F)n(CC2CCCC2)n1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 3/20 0.48
MAPK14 Q16539 6/20 0.48
CNR2 P34972 5/20 0.44
CNR1 P21554 2/20 0.44
CRHR1 P34998 5/20 0.44
CRHR2 Q13324 1/20 0.44
MAPK13 O15264 2/20 0.44
HTR2C P28335 1/20 0.43
SLC6A4 P31645 1/20 0.43

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
SCHEMBL283144 0.98 P2RY14 (0.48) P2RY14MAPK14CNR2CNR1CRHR1
SCHEMBL283367 0.87 CNR2 (0.60) CNR2
SCHEMBL17713941 0.85 CNR2 (0.57) P2RY14MAPK14CNR2CRHR1CRHR2
SCHEMBL2813991 0.84 CNR2 (0.46) MAPK14CNR2CNR1CRHR1CRHR2
SCHEMBL283719 0.82 RET (0.41) P2RY14MAPK14CNR2CNR1
SCHEMBL283889 0.82 CNR2 (0.46) CNR2CNR1
SCHEMBL283574 0.82 RET (0.40) P2RY14MAPK14CNR2CNR1
SCHEMBL284405 0.81 CNR2 (0.45) P2RY14MAPK14CNR2CNR1
SCHEMBL283706 0.81 NPSR1 (0.55) P2RY14
SCHEMBL283651 0.78 MAPK14 (0.49) P2RY14MAPK14MAPK13HTR2CSLC6A4

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 6 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-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
CN-102216277-A Substituted benzamides as cannabinoid receptor ligands ABBOTT LAB 2011-10-12 CN 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 (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-20100069349-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R P2RY14 169/4885MAPK14 2205/4885CNR2 2/4885

“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.