SCHEMBL12345501

SCHEMBL12345501

CCC(C)CC(=O)N(C)OC

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.33
ELANE P08246 1/20 0.32

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
SCHEMBL1781585 0.82 ALDH1A1 (0.33) FAAH
SCHEMBL12567246 0.82 ALDH1A1 (0.39) FAAH
SCHEMBL13415700 0.82 ALDH1A1 (0.39) FAAH
SCHEMBL2369153 0.80 FAAH (0.43) FAAH
SCHEMBL7360452 0.80 FAAH (0.32) FAAH
SCHEMBL24759068 0.78 FAAH (0.35) FAAH
SCHEMBL16689921 0.78 FAAH (0.35) FAAH
SCHEMBL14671182 0.78 ALDH1A1 (0.41) ELANE
SCHEMBL753366 0.78
SCHEMBL18762469 0.77 MLYCD (0.34) FAAH

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9532987-B2 Use of a combination of a MEK inhibitor and an ERK inhibitor for treatment of hyperproliferative diseases GENENTECH, INC. (US) 2017-01-03 US disclosed
US-20150111869-A1 USE OF A COMBINATION OF A MEK INHIBITOR AND AN ERK INHIBITOR FOR TREATMENT OF HYPERPROLIFERATIVE DISEASES GENENTECH, INC. (US) 2015-04-23 US disclosed
US-20150111869-A1 USE OF A COMBINATION OF A MEK INHIBITOR AND AN ERK INHIBITOR FOR TREATMENT OF HYPERPROLIFERATIVE DISEASES GENENTECH, INC. (US) 2015-04-23 US disclosed
WO-2015032840-A1 COMBINATION OF A MEK INHIBITOR AND AN ERK INHIBITOR FOR USE IN TREATMENT OF HYPERPROLIFERATIVE DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2015-03-12 WO disclosed
EP-2318375-B1 IMIDAZOLE CARBOXAMIDES LILLY CO ELI (US) 2012-09-19 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-20150111869-A1 USE OF A COMBINATION OF A MEK INHIBITOR AND AN ERK INHIBITOR FOR TREATMENT OF HYPERPROLIFERATIVE DISEASES MAPK13, MAPK3, MAPK1 FAAH 4355/4885ELANE 961/4885

“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.